Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
11575 | 1rq6 RC | 6028 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1HT MET 1 -24.571 8.279 -12.329
2 2H MET 1 2HT MET 1 -23.725 9.008 -13.609
3 3H MET 1 3HT MET 1 -24.067 9.893 -12.207
4 HA MET 1 HA MET 1 -22.630 8.550 -10.895
5 1HB MET 1 2HB MET 1 -21.320 6.743 -11.853
6 2HB MET 1 1HB MET 1 -23.030 6.433 -12.109
7 1HG MET 1 2HG MET 1 -22.858 7.119 -14.409
8 2HG MET 1 1HG MET 1 -21.178 7.595 -14.172
9 1HE MET 1 1HE MET 1 -23.710 4.595 -14.403
10 2HE MET 1 2HE MET 1 -23.057 4.424 -12.774
11 3HE MET 1 3HE MET 1 -22.669 3.227 -14.012
12 H GLY 2 H GLY 2 -20.158 8.521 -11.098
13 1HA GLY 2 2HA GLY 2 -19.263 10.549 -13.054
14 2HA GLY 2 1HA GLY 2 -18.753 10.600 -11.370
15 H ASN 3 H ASN 3 -16.562 10.416 -11.940
16 HA ASN 3 HA ASN 3 -15.675 8.049 -13.375
17 1HB ASN 3 2HB ASN 3 -14.151 10.309 -12.071
18 2HB ASN 3 1HB ASN 3 -13.387 8.973 -12.925
19 1HD2 ASN 3 1HD2 ASN 3 -15.249 11.887 -13.225
20 2HD2 ASN 3 2HD2 ASN 3 -15.091 12.047 -14.944
21 H ILE 4 H ILE 4 -14.297 6.443 -12.477
22 HA ILE 4 HA ILE 4 -15.062 5.647 -9.840
23 HB ILE 4 HB ILE 4 -12.898 4.469 -11.595
24 1HG1 ILE 4 2HG1 ILE 4 -15.799 3.654 -11.345
25 2HG1 ILE 4 1HG1 ILE 4 -15.142 4.577 -12.689
26 1HG2 ILE 4 1HG2 ILE 4 -14.452 3.291 -9.294
27 2HG2 ILE 4 2HG2 ILE 4 -12.755 3.768 -9.261
28 3HG2 ILE 4 3HG2 ILE 4 -13.276 2.431 -10.288
29 1HD1 ILE 4 1HD1 ILE 4 -14.352 1.778 -11.919
30 2HD1 ILE 4 2HD1 ILE 4 -13.696 2.702 -13.270
31 3HD1 ILE 4 3HD1 ILE 4 -15.396 2.236 -13.264
32 H ARG 5 H ARG 5 -11.793 6.048 -11.197
33 HA ARG 5 HA ARG 5 -9.879 6.930 -10.385
34 1HB ARG 5 2HB ARG 5 -11.048 9.007 -10.444
35 2HB ARG 5 1HB ARG 5 -11.871 8.656 -8.931
36 1HG ARG 5 2HG ARG 5 -9.812 8.871 -7.705
37 2HG ARG 5 1HG ARG 5 -8.903 9.072 -9.207
38 1HD ARG 5 2HD ARG 5 -11.157 10.920 -8.528
39 2HD ARG 5 1HD ARG 5 -9.558 11.165 -7.827
40 HE ARG 5 HE ARG 5 -8.709 11.356 -10.120
41 1HH1 ARG 5 1HH1 ARG 5 -12.175 11.735 -9.662
42 2HH1 ARG 5 2HH1 ARG 5 -12.353 12.791 -11.036
43 1HH2 ARG 5 1HH2 ARG 5 -8.951 12.717 -11.908
44 2HH2 ARG 5 2HH2 ARG 5 -10.520 13.348 -12.314
45 H THR 6 H THR 6 -9.213 5.017 -9.390
46 HA THR 6 HA THR 6 -8.546 5.425 -6.640
47 HB THR 6 HB THR 6 -10.818 4.413 -6.425
48 HG1 THR 6 1HG THR 6 -9.239 4.094 -4.793
49 1HG2 THR 6 1HG2 THR 6 -11.115 2.030 -6.924
50 2HG2 THR 6 2HG2 THR 6 -9.514 1.983 -7.661
51 3HG2 THR 6 3HG2 THR 6 -10.793 2.955 -8.391
52 H SER 7 H SER 7 -8.405 3.612 -9.595
53 HA SER 7 HA SER 7 -6.585 1.610 -8.894
54 1HB SER 7 2HB SER 7 -7.857 1.591 -10.986
55 2HB SER 7 1HB SER 7 -6.953 2.990 -11.566
56 HG SER 7 HG SER 7 -5.971 1.217 -12.432
57 H PHE 8 H PHE 8 -6.057 4.983 -9.670
58 HA PHE 8 HA PHE 8 -3.297 4.834 -10.186
59 1HB PHE 8 2HB PHE 8 -5.039 7.091 -9.211
60 2HB PHE 8 1HB PHE 8 -3.321 7.292 -9.538
61 HD1 PHE 8 1HD PHE 8 -6.627 6.790 -11.004
62 HD2 PHE 8 2HD PHE 8 -2.463 7.175 -11.803
63 HE1 PHE 8 1HE PHE 8 -7.123 7.167 -13.384
64 HE2 PHE 8 2HE PHE 8 -2.952 7.554 -14.186
65 HZ PHE 8 HZ PHE 8 -5.284 7.547 -14.979
66 H VAL 9 H VAL 9 -5.118 5.136 -7.188
67 HA VAL 9 HA VAL 9 -2.906 5.638 -5.487
68 HB VAL 9 HB VAL 9 -5.506 4.255 -4.782
69 1HG1 VAL 9 1HG1 VAL 9 -5.062 5.066 -2.514
70 2HG1 VAL 9 2HG1 VAL 9 -3.523 5.734 -3.058
71 3HG1 VAL 9 3HG1 VAL 9 -3.783 3.990 -3.080
72 1HG2 VAL 9 1HG2 VAL 9 -5.912 6.417 -5.846
73 2HG2 VAL 9 2HG2 VAL 9 -4.821 7.192 -4.698
74 3HG2 VAL 9 3HG2 VAL 9 -6.322 6.462 -4.131
75 H LYS 10 H LYS 10 -4.457 2.757 -6.714
76 HA LYS 10 HA LYS 10 -3.037 0.850 -5.193
77 1HB LYS 10 2HB LYS 10 -5.121 0.316 -6.328
78 2HB LYS 10 1HB LYS 10 -4.390 0.641 -7.889
79 1HG LYS 10 2HG LYS 10 -3.011 -1.293 -7.730
80 2HG LYS 10 1HG LYS 10 -3.463 -1.541 -6.040
81 1HD LYS 10 2HD LYS 10 -5.735 -2.030 -6.670
82 2HD LYS 10 1HD LYS 10 -5.395 -1.632 -8.355
83 1HE LYS 10 2HE LYS 10 -3.958 -3.821 -6.884
84 2HE LYS 10 1HE LYS 10 -5.470 -4.094 -7.748
85 1HZ LYS 10 1HZ LYS 10 -4.439 -3.402 -9.782
86 2HZ LYS 10 2HZ LYS 10 -3.489 -4.615 -9.075
87 3HZ LYS 10 3HZ LYS 10 -3.000 -2.992 -8.982
88 H ARG 11 H ARG 11 -2.361 2.509 -8.221
89 HA ARG 11 HA ARG 11 -0.129 0.950 -8.984
90 1HB ARG 11 2HB ARG 11 -1.364 2.528 -10.491
91 2HB ARG 11 1HB ARG 11 -0.620 3.864 -9.622
92 1HG ARG 11 2HG ARG 11 1.604 2.980 -10.264
93 2HG ARG 11 1HG ARG 11 0.797 1.752 -11.236
94 1HD ARG 11 2HD ARG 11 -0.279 3.554 -12.546
95 2HD ARG 11 1HD ARG 11 0.635 4.741 -11.613
96 HE ARG 11 HE ARG 11 1.945 2.668 -13.264
97 1HH1 ARG 11 1HH1 ARG 11 1.563 6.012 -12.272
98 2HH1 ARG 11 2HH1 ARG 11 2.960 6.561 -13.157
99 1HH2 ARG 11 1HH2 ARG 11 3.760 3.378 -14.416
100 2HH2 ARG 11 2HH2 ARG 11 4.230 5.050 -14.361
101 H ILE 12 H ILE 12 -0.456 3.905 -7.058
102 HA ILE 12 HA ILE 12 2.292 4.337 -6.609
103 HB ILE 12 HB ILE 12 -0.213 5.250 -5.270
104 1HG1 ILE 12 2HG1 ILE 12 0.809 7.470 -5.678
105 2HG1 ILE 12 1HG1 ILE 12 2.241 6.678 -6.320
106 1HG2 ILE 12 1HG2 ILE 12 2.507 5.565 -4.010
107 2HG2 ILE 12 2HG2 ILE 12 1.139 4.673 -3.348
108 3HG2 ILE 12 3HG2 ILE 12 1.049 6.426 -3.515
109 1HD1 ILE 12 1HD1 ILE 12 0.925 5.752 -8.139
110 2HD1 ILE 12 2HD1 ILE 12 0.800 7.511 -8.087
111 3HD1 ILE 12 3HD1 ILE 12 -0.525 6.515 -7.486
112 H ALA 13 H ALA 13 -0.114 2.421 -4.857
113 HA ALA 13 HA ALA 13 1.514 1.589 -2.732
114 1HB ALA 13 1HB ALA 13 -0.711 0.052 -4.072
115 2HB ALA 13 2HB ALA 13 -0.912 1.238 -2.783
116 3HB ALA 13 3HB ALA 13 -0.044 -0.265 -2.470
117 H LYS 14 H LYS 14 0.925 0.104 -5.906
118 HA LYS 14 HA LYS 14 2.592 -2.112 -5.657
119 1HB LYS 14 2HB LYS 14 1.721 -0.478 -8.024
120 2HB LYS 14 1HB LYS 14 2.839 -1.821 -8.220
121 1HG LYS 14 2HG LYS 14 0.156 -2.107 -6.900
122 2HG LYS 14 1HG LYS 14 0.422 -2.345 -8.629
123 1HD LYS 14 2HD LYS 14 1.855 -3.849 -6.439
124 2HD LYS 14 1HD LYS 14 0.463 -4.460 -7.336
125 1HE LYS 14 2HE LYS 14 1.732 -4.301 -9.420
126 2HE LYS 14 1HE LYS 14 3.120 -3.671 -8.533
127 1HZ LYS 14 1HZ LYS 14 1.909 -6.345 -8.083
128 2HZ LYS 14 2HZ LYS 14 3.330 -5.741 -7.370
129 3HZ LYS 14 3HZ LYS 14 3.284 -6.061 -9.036
130 H GLU 15 H GLU 15 3.375 1.118 -6.934
131 HA GLU 15 HA GLU 15 6.058 0.642 -7.550
132 1HB GLU 15 2HB GLU 15 4.714 2.642 -8.217
133 2HB GLU 15 1HB GLU 15 4.846 3.233 -6.568
134 1HG GLU 15 2HG GLU 15 6.449 4.355 -7.948
135 2HG GLU 15 1HG GLU 15 7.296 3.299 -6.817
136 H MET 16 H MET 16 4.526 1.595 -4.533
137 HA MET 16 HA MET 16 6.912 2.158 -3.095
138 1HB MET 16 2HB MET 16 4.628 2.998 -2.527
139 2HB MET 16 1HB MET 16 4.212 1.374 -1.999
140 1HG MET 16 2HG MET 16 5.883 1.469 -0.266
141 2HG MET 16 1HG MET 16 6.420 3.048 -0.837
142 1HE MET 16 1HE MET 16 3.444 4.212 -1.620
143 2HE MET 16 2HE MET 16 4.710 5.202 -0.890
144 3HE MET 16 3HE MET 16 3.101 5.152 -0.167
145 H ILE 17 H ILE 17 4.810 -0.699 -3.277
146 HA ILE 17 HA ILE 17 6.309 -2.165 -1.323
147 HB ILE 17 HB ILE 17 4.325 -3.222 -3.344
148 1HG1 ILE 17 2HG1 ILE 17 3.835 -2.413 -0.469
149 2HG1 ILE 17 1HG1 ILE 17 3.408 -1.423 -1.861
150 1HG2 ILE 17 1HG2 ILE 17 5.741 -4.945 -2.351
151 2HG2 ILE 17 2HG2 ILE 17 4.075 -5.085 -1.790
152 3HG2 ILE 17 3HG2 ILE 17 5.304 -4.383 -0.738
153 1HD1 ILE 17 1HD1 ILE 17 1.473 -2.611 -1.049
154 2HD1 ILE 17 2HD1 ILE 17 2.315 -4.150 -1.211
155 3HD1 ILE 17 3HD1 ILE 17 1.914 -3.208 -2.648
156 H GLU 18 H GLU 18 6.049 -2.283 -4.863
157 HA GLU 18 HA GLU 18 7.485 -4.695 -5.158
158 1HB GLU 18 2HB GLU 18 5.942 -3.088 -6.776
159 2HB GLU 18 1HB GLU 18 7.545 -2.930 -7.479
160 1HG GLU 18 2HG GLU 18 6.269 -4.723 -8.521
161 2HG GLU 18 1HG GLU 18 7.713 -5.332 -7.711
162 H THR 19 H THR 19 8.665 -1.639 -4.386
163 HA THR 19 HA THR 19 11.138 -1.808 -5.841
164 HB THR 19 HB THR 19 10.068 0.356 -5.017
165 HG1 THR 19 1HG THR 19 12.493 -0.178 -5.533
166 1HG2 THR 19 1HG2 THR 19 9.578 -0.311 -2.732
167 2HG2 THR 19 2HG2 THR 19 10.680 1.067 -2.736
168 3HG2 THR 19 3HG2 THR 19 11.295 -0.554 -2.413
169 H HIS 20 H HIS 20 9.863 -3.187 -3.015
170 HA HIS 20 HA HIS 20 12.450 -4.403 -2.409
171 1HB HIS 20 2HB HIS 20 12.225 -2.488 -0.855
172 2HB HIS 20 1HB HIS 20 10.681 -3.124 -0.300
173 HD1 HIS 20 1HD HIS 20 12.303 -2.814 1.991
174 HD2 HIS 20 2HD HIS 20 12.950 -6.091 -0.495
175 HE1 HIS 20 1HE HIS 20 13.492 -4.519 3.400
176 HE2 HIS 20 2HE HIS 20 13.690 -6.558 1.940
177 HA PRO 21 HA PRO 21 9.421 -7.709 -2.801
178 1HB PRO 21 2HB PRO 21 11.798 -9.424 -2.516
179 2HB PRO 21 1HB PRO 21 10.644 -9.309 -3.849
180 1HG PRO 21 2HG PRO 21 13.136 -8.368 -4.087
181 2HG PRO 21 1HG PRO 21 11.759 -7.540 -4.837
182 1HD PRO 21 2HD PRO 21 13.205 -6.881 -2.291
183 2HD PRO 21 1HD PRO 21 12.666 -5.792 -3.589
184 H GLY 22 H GLY 22 10.336 -6.589 -0.086
185 1HA GLY 22 2HA GLY 22 10.288 -8.963 1.600
186 2HA GLY 22 1HA GLY 22 10.314 -7.288 2.149
187 H LYS 23 H LYS 23 8.222 -9.460 0.298
188 HA LYS 23 HA LYS 23 5.890 -7.972 1.294
189 1HB LYS 23 2HB LYS 23 6.389 -7.962 -1.163
190 2HB LYS 23 1HB LYS 23 6.143 -9.699 -1.176
191 1HG LYS 23 2HG LYS 23 3.810 -9.286 -0.374
192 2HG LYS 23 1HG LYS 23 4.103 -7.561 -0.612
193 1HD LYS 23 2HD LYS 23 4.235 -9.712 -2.727
194 2HD LYS 23 1HD LYS 23 2.970 -8.495 -2.547
195 1HE LYS 23 2HE LYS 23 4.527 -6.729 -3.049
196 2HE LYS 23 1HE LYS 23 5.876 -7.865 -3.054
197 1HZ LYS 23 1HZ LYS 23 3.619 -7.819 -4.985
198 2HZ LYS 23 2HZ LYS 23 4.854 -8.978 -4.962
199 3HZ LYS 23 3HZ LYS 23 5.221 -7.355 -5.297
200 H PHE 24 H PHE 24 3.967 -9.166 1.744
201 HA PHE 24 HA PHE 24 2.682 -10.837 2.539
202 1HB PHE 24 2HB PHE 24 3.327 -11.933 0.388
203 2HB PHE 24 1HB PHE 24 4.659 -12.716 1.228
204 HD1 PHE 24 1HD PHE 24 4.336 -14.826 2.100
205 HD2 PHE 24 2HD PHE 24 0.961 -12.329 1.422
206 HE1 PHE 24 1HE PHE 24 2.848 -16.676 2.734
207 HE2 PHE 24 2HE PHE 24 -0.536 -14.172 2.057
208 HZ PHE 24 HZ PHE 24 0.406 -16.351 2.717
209 H THR 25 H THR 25 4.231 -9.773 4.425
210 HA THR 25 HA THR 25 5.146 -12.092 5.983
211 HB THR 25 HB THR 25 5.478 -9.187 6.759
212 HG1 THR 25 1HG THR 25 6.754 -10.684 4.813
213 1HG2 THR 25 1HG2 THR 25 6.997 -11.695 7.509
214 2HG2 THR 25 2HG2 THR 25 5.848 -10.841 8.538
215 3HG2 THR 25 3HG2 THR 25 7.360 -10.065 8.072
216 H ASP 26 H ASP 26 2.481 -10.411 5.338
217 HA ASP 26 HA ASP 26 0.464 -10.009 6.264
218 1HB ASP 26 2HB ASP 26 -0.580 -11.959 7.270
219 2HB ASP 26 1HB ASP 26 0.394 -12.412 5.883
220 H ASP 27 H ASP 27 2.483 -8.726 7.797
221 HA ASP 27 HA ASP 27 0.997 -8.583 10.325
222 1HB ASP 27 2HB ASP 27 3.161 -9.732 10.702
223 2HB ASP 27 1HB ASP 27 4.003 -8.325 10.062
224 H PHE 28 H PHE 28 0.740 -6.510 11.190
225 HA PHE 28 HA PHE 28 0.582 -4.454 9.245
226 1HB PHE 28 2HB PHE 28 0.206 -4.413 12.240
227 2HB PHE 28 1HB PHE 28 -0.073 -3.013 11.212
228 HD1 PHE 28 1HD PHE 28 -1.993 -2.896 9.763
229 HD2 PHE 28 2HD PHE 28 -1.291 -6.329 12.176
230 HE1 PHE 28 1HE PHE 28 -4.302 -3.643 9.363
231 HE2 PHE 28 2HE PHE 28 -3.597 -7.085 11.779
232 HZ PHE 28 HZ PHE 28 -5.107 -5.739 10.374
233 H ASP 29 H ASP 29 2.881 -5.170 11.807
234 HA ASP 29 HA ASP 29 4.186 -2.652 11.799
235 1HB ASP 29 2HB ASP 29 4.380 -4.373 13.614
236 2HB ASP 29 1HB ASP 29 5.379 -5.334 12.529
237 H THR 30 H THR 30 4.677 -5.652 10.040
238 HA THR 30 HA THR 30 7.094 -5.017 8.782
239 HB THR 30 HB THR 30 4.908 -6.686 7.537
240 HG1 THR 30 1HG THR 30 6.687 -7.251 9.683
241 1HG2 THR 30 1HG2 THR 30 6.806 -7.936 6.606
242 2HG2 THR 30 2HG2 THR 30 7.924 -6.829 7.405
243 3HG2 THR 30 3HG2 THR 30 6.859 -6.239 6.128
244 H ASN 31 H ASN 31 3.741 -4.664 7.605
245 HA ASN 31 HA ASN 31 4.446 -3.462 5.159
246 1HB ASN 31 2HB ASN 31 1.852 -3.307 6.710
247 2HB ASN 31 1HB ASN 31 2.056 -2.844 5.021
248 1HD2 ASN 31 1HD2 ASN 31 0.365 -4.916 6.256
249 2HD2 ASN 31 2HD2 ASN 31 0.812 -6.392 5.477
250 H LYS 32 H LYS 32 3.812 -2.179 8.353
251 HA LYS 32 HA LYS 32 3.632 0.545 7.755
252 1HB LYS 32 2HB LYS 32 3.182 -0.389 9.992
253 2HB LYS 32 1HB LYS 32 4.889 -0.765 10.179
254 1HG LYS 32 2HG LYS 32 5.417 1.628 10.070
255 2HG LYS 32 1HG LYS 32 3.694 1.991 9.932
256 1HD LYS 32 2HD LYS 32 3.344 0.834 12.112
257 2HD LYS 32 1HD LYS 32 5.093 0.666 12.253
258 1HE LYS 32 2HE LYS 32 3.666 3.303 11.957
259 2HE LYS 32 1HE LYS 32 4.130 2.601 13.504
260 1HZ LYS 32 1HZ LYS 32 5.717 4.257 12.643
261 2HZ LYS 32 2HZ LYS 32 6.050 3.242 11.323
262 3HZ LYS 32 3HZ LYS 32 6.424 2.738 12.900
263 H LYS 33 H LYS 33 6.494 -1.368 8.644
264 HA LYS 33 HA LYS 33 8.342 0.741 8.261
265 1HB LYS 33 2HB LYS 33 8.564 -2.227 8.563
266 2HB LYS 33 1HB LYS 33 9.973 -1.308 8.062
267 1HG LYS 33 2HG LYS 33 9.933 -1.720 10.474
268 2HG LYS 33 1HG LYS 33 9.899 0.000 10.092
269 1HD LYS 33 2HD LYS 33 7.517 0.084 10.525
270 2HD LYS 33 1HD LYS 33 7.474 -1.658 10.788
271 1HE LYS 33 2HE LYS 33 9.060 0.293 12.455
272 2HE LYS 33 1HE LYS 33 7.467 -0.333 12.884
273 1HZ LYS 33 1HZ LYS 33 9.212 -1.578 13.983
274 2HZ LYS 33 2HZ LYS 33 9.922 -1.963 12.496
275 3HZ LYS 33 3HZ LYS 33 8.384 -2.572 12.886
276 H LEU 34 H LEU 34 7.114 -1.797 6.160
277 HA LEU 34 HA LEU 34 8.849 -1.531 3.992
278 1HB LEU 34 2HB LEU 34 7.157 -3.318 4.282
279 2HB LEU 34 1HB LEU 34 5.891 -2.154 3.951
280 HG LEU 34 HG LEU 34 6.858 -1.842 1.663
281 1HD1 LEU 34 1HD1 LEU 34 8.422 -3.522 0.826
282 2HD1 LEU 34 2HD1 LEU 34 8.552 -4.211 2.445
283 3HD1 LEU 34 3HD1 LEU 34 9.139 -2.577 2.132
284 1HD2 LEU 34 1HD2 LEU 34 5.976 -3.931 0.784
285 2HD2 LEU 34 2HD2 LEU 34 4.952 -3.320 2.084
286 3HD2 LEU 34 3HD2 LEU 34 6.060 -4.659 2.388
287 H VAL 35 H VAL 35 5.910 0.262 4.806
288 HA VAL 35 HA VAL 35 5.904 1.896 2.484
289 HB VAL 35 HB VAL 35 4.645 2.352 5.198
290 1HG1 VAL 35 1HG1 VAL 35 4.164 3.835 2.615
291 2HG1 VAL 35 2HG1 VAL 35 4.980 4.481 4.039
292 3HG1 VAL 35 3HG1 VAL 35 3.270 4.055 4.120
293 1HG2 VAL 35 1HG2 VAL 35 3.774 0.406 4.016
294 2HG2 VAL 35 2HG2 VAL 35 3.467 1.399 2.590
295 3HG2 VAL 35 3HG2 VAL 35 2.571 1.696 4.082
296 H GLU 36 H GLU 36 7.189 2.321 5.762
297 HA GLU 36 HA GLU 36 7.793 5.072 5.396
298 1HB GLU 36 2HB GLU 36 8.735 3.131 7.502
299 2HB GLU 36 1HB GLU 36 8.974 4.873 7.563
300 1HG GLU 36 2HG GLU 36 6.500 5.145 7.486
301 2HG GLU 36 1HG GLU 36 6.353 3.393 7.618
302 H GLU 37 H GLU 37 9.602 2.160 4.747
303 HA GLU 37 HA GLU 37 12.136 3.516 4.699
304 1HB GLU 37 2HB GLU 37 13.030 1.428 3.774
305 2HB GLU 37 1HB GLU 37 12.086 1.155 5.228
306 1HG GLU 37 2HG GLU 37 10.220 0.373 3.909
307 2HG GLU 37 1HG GLU 37 11.097 0.723 2.421
308 H PHE 38 H PHE 38 9.541 3.227 2.528
309 HA PHE 38 HA PHE 38 11.258 4.238 0.359
310 1HB PHE 38 2HB PHE 38 10.042 2.119 -0.159
311 2HB PHE 38 1HB PHE 38 8.521 2.969 0.091
312 HD1 PHE 38 1HD PHE 38 11.644 3.153 -1.932
313 HD2 PHE 38 2HD PHE 38 7.470 3.950 -1.713
314 HE1 PHE 38 1HE PHE 38 11.652 3.839 -4.293
315 HE2 PHE 38 2HE PHE 38 7.473 4.639 -4.070
316 HZ PHE 38 HZ PHE 38 9.565 4.583 -5.366
317 H SER 39 H SER 39 7.754 4.446 0.772
318 HA SER 39 HA SER 39 6.303 6.167 1.008
319 1HB SER 39 2HB SER 39 8.699 7.549 2.230
320 2HB SER 39 1HB SER 39 7.059 8.195 2.260
321 HG SER 39 HG SER 39 7.489 5.579 3.172
322 H THR 40 H THR 40 5.708 6.737 -0.987
323 HA THR 40 HA THR 40 7.098 9.046 -2.158
324 HB THR 40 HB THR 40 7.616 6.953 -3.439
325 HG1 THR 40 1HG THR 40 7.545 9.044 -4.458
326 1HG2 THR 40 1HG2 THR 40 5.503 5.773 -3.113
327 2HG2 THR 40 2HG2 THR 40 5.861 5.954 -4.829
328 3HG2 THR 40 3HG2 THR 40 4.659 6.995 -4.065
329 H VAL 41 H VAL 41 4.657 8.498 -0.454
330 HA VAL 41 HA VAL 41 2.551 9.485 -2.246
331 HB VAL 41 HB VAL 41 2.067 7.320 -1.180
332 1HG1 VAL 41 1HG1 VAL 41 3.330 7.556 0.868
333 2HG1 VAL 41 2HG1 VAL 41 1.644 7.195 1.237
334 3HG1 VAL 41 3HG1 VAL 41 2.253 8.841 1.416
335 1HG2 VAL 41 1HG2 VAL 41 0.341 9.589 -0.203
336 2HG2 VAL 41 2HG2 VAL 41 -0.140 7.892 -0.259
337 3HG2 VAL 41 3HG2 VAL 41 0.212 8.759 -1.754
338 H SER 42 H SER 42 1.527 11.366 -1.808
339 HA SER 42 HA SER 42 2.605 13.057 0.286
340 1HB SER 42 2HB SER 42 0.517 13.657 -1.830
341 2HB SER 42 1HB SER 42 1.309 14.840 -0.785
342 HG SER 42 HG SER 42 3.229 14.466 -1.815
343 H THR 43 H THR 43 1.014 14.377 1.583
344 HA THR 43 HA THR 43 -0.646 14.520 3.129
345 HB THR 43 HB THR 43 -2.018 12.277 1.634
346 HG1 THR 43 1HG THR 43 -1.551 14.783 0.889
347 1HG2 THR 43 1HG2 THR 43 -3.103 14.304 3.600
348 2HG2 THR 43 2HG2 THR 43 -2.875 12.581 3.908
349 3HG2 THR 43 3HG2 THR 43 -4.058 13.111 2.711
350 H LYS 44 H LYS 44 0.040 13.935 5.059
351 HA LYS 44 HA LYS 44 1.573 11.585 5.407
352 1HB LYS 44 2HB LYS 44 0.546 13.536 7.471
353 2HB LYS 44 1HB LYS 44 1.778 12.313 7.755
354 1HG LYS 44 2HG LYS 44 1.987 14.629 5.839
355 2HG LYS 44 1HG LYS 44 2.785 14.490 7.406
356 1HD LYS 44 2HD LYS 44 4.056 12.576 6.616
357 2HD LYS 44 1HD LYS 44 3.212 12.628 5.067
358 1HE LYS 44 2HE LYS 44 4.151 14.840 4.627
359 2HE LYS 44 1HE LYS 44 4.984 14.803 6.177
360 1HZ LYS 44 1HZ LYS 44 5.448 12.903 3.934
361 2HZ LYS 44 2HZ LYS 44 6.265 12.908 5.425
362 3HZ LYS 44 3HZ LYS 44 6.456 14.202 4.351
363 H HIS 45 H HIS 45 -1.754 12.369 6.312
364 HA HIS 45 HA HIS 45 -2.024 9.996 7.926
365 1HB HIS 45 2HB HIS 45 -3.355 12.099 8.303
366 2HB HIS 45 1HB HIS 45 -4.244 11.734 6.827
367 HD1 HIS 45 1HD HIS 45 -6.284 10.334 7.104
368 HD2 HIS 45 2HD HIS 45 -3.675 9.961 10.328
369 HE1 HIS 45 1HE HIS 45 -7.472 8.880 8.785
370 HE2 HIS 45 2HE HIS 45 -5.847 8.600 10.695
371 H LEU 46 H LEU 46 -2.035 10.593 4.612
372 HA LEU 46 HA LEU 46 -3.960 8.615 3.835
373 1HB LEU 46 2HB LEU 46 -3.284 10.543 2.403
374 2HB LEU 46 1HB LEU 46 -1.701 9.812 2.223
375 HG LEU 46 HG LEU 46 -2.737 7.873 1.091
376 1HD1 LEU 46 1HD1 LEU 46 -4.933 7.956 2.134
377 2HD1 LEU 46 2HD1 LEU 46 -5.074 8.010 0.377
378 3HD1 LEU 46 3HD1 LEU 46 -5.275 9.484 1.323
379 1HD2 LEU 46 1HD2 LEU 46 -3.328 9.042 -0.986
380 2HD2 LEU 46 2HD2 LEU 46 -1.881 9.715 -0.235
381 3HD2 LEU 46 3HD2 LEU 46 -3.422 10.560 -0.092
382 H ARG 47 H ARG 47 -0.681 8.635 4.816
383 HA ARG 47 HA ARG 47 0.297 6.291 3.642
384 1HB ARG 47 2HB ARG 47 1.681 7.942 4.882
385 2HB ARG 47 1HB ARG 47 0.952 7.394 6.385
386 1HG ARG 47 2HG ARG 47 1.864 5.134 5.949
387 2HG ARG 47 1HG ARG 47 2.682 5.780 4.528
388 1HD ARG 47 2HD ARG 47 4.246 5.705 6.348
389 2HD ARG 47 1HD ARG 47 3.865 7.390 5.994
390 HE ARG 47 HE ARG 47 2.877 7.589 8.064
391 1HH1 ARG 47 1HH1 ARG 47 3.471 4.205 7.392
392 2HH1 ARG 47 2HH1 ARG 47 3.157 3.699 9.020
393 1HH2 ARG 47 1HH2 ARG 47 2.509 6.916 10.232
394 2HH2 ARG 47 2HH2 ARG 47 2.634 5.228 10.627
395 H ASN 48 H ASN 48 -1.824 6.816 6.356
396 HA ASN 48 HA ASN 48 -1.692 4.290 7.575
397 1HB ASN 48 2HB ASN 48 -4.069 6.160 7.387
398 2HB ASN 48 1HB ASN 48 -3.907 4.823 8.519
399 1HD2 ASN 48 1HD2 ASN 48 -4.060 6.076 10.324
400 2HD2 ASN 48 2HD2 ASN 48 -2.840 7.214 10.803
401 H LYS 49 H LYS 49 -3.725 5.539 4.976
402 HA LYS 49 HA LYS 49 -5.292 3.196 4.674
403 1HB LYS 49 2HB LYS 49 -4.744 5.451 2.732
404 2HB LYS 49 1HB LYS 49 -5.957 4.200 2.496
405 1HG LYS 49 2HG LYS 49 -7.125 4.944 4.508
406 2HG LYS 49 1HG LYS 49 -5.906 6.198 4.752
407 1HD LYS 49 2HD LYS 49 -6.519 7.215 2.618
408 2HD LYS 49 1HD LYS 49 -7.720 5.948 2.352
409 1HE LYS 49 2HE LYS 49 -7.742 7.866 4.680
410 2HE LYS 49 1HE LYS 49 -8.675 8.081 3.201
411 1HZ LYS 49 1HZ LYS 49 -8.927 5.787 5.082
412 2HZ LYS 49 2HZ LYS 49 -9.836 6.014 3.667
413 3HZ LYS 49 3HZ LYS 49 -10.003 7.093 4.958
414 H ILE 50 H ILE 50 -2.276 4.313 3.282
415 HA ILE 50 HA ILE 50 -2.017 2.330 1.288
416 HB ILE 50 HB ILE 50 0.160 3.794 2.791
417 1HG1 ILE 50 2HG1 ILE 50 -1.367 5.330 1.659
418 2HG1 ILE 50 1HG1 ILE 50 0.188 5.302 0.838
419 1HG2 ILE 50 1HG2 ILE 50 1.572 3.269 0.851
420 2HG2 ILE 50 2HG2 ILE 50 0.269 2.290 0.177
421 3HG2 ILE 50 3HG2 ILE 50 1.034 1.818 1.695
422 1HD1 ILE 50 1HD1 ILE 50 -1.608 5.344 -0.766
423 2HD1 ILE 50 2HD1 ILE 50 -2.325 3.901 -0.046
424 3HD1 ILE 50 3HD1 ILE 50 -0.763 3.799 -0.860
425 H ALA 51 H ALA 51 -0.766 2.511 4.616
426 HA ALA 51 HA ALA 51 0.548 0.030 4.636
427 1HB ALA 51 1HB ALA 51 0.924 1.767 6.325
428 2HB ALA 51 2HB ALA 51 0.524 0.213 7.062
429 3HB ALA 51 3HB ALA 51 -0.694 1.487 6.969
430 H GLY 52 H GLY 52 -2.763 0.912 5.544
431 1HA GLY 52 2HA GLY 52 -3.557 -1.688 6.362
432 2HA GLY 52 1HA GLY 52 -4.632 -0.379 5.894
433 H TYR 53 H TYR 53 -3.492 -0.048 3.276
434 HA TYR 53 HA TYR 53 -5.107 -1.818 1.807
435 1HB TYR 53 2HB TYR 53 -4.143 0.536 1.215
436 2HB TYR 53 1HB TYR 53 -2.769 -0.373 0.599
437 HD1 TYR 53 1HD TYR 53 -6.419 0.122 0.234
438 HD2 TYR 53 2HD TYR 53 -2.862 -1.414 -1.523
439 HE1 TYR 53 1HE TYR 53 -7.610 -0.182 -1.895
440 HE2 TYR 53 2HE TYR 53 -4.046 -1.725 -3.655
441 HH TYR 53 HH TYR 53 -6.385 -2.040 -4.430
442 H ILE 54 H ILE 54 -1.584 -1.716 2.301
443 HA ILE 54 HA ILE 54 -0.888 -3.916 0.711
444 HB ILE 54 HB ILE 54 0.466 -3.174 3.306
445 1HG1 ILE 54 2HG1 ILE 54 0.949 -2.016 0.552
446 2HG1 ILE 54 1HG1 ILE 54 0.157 -1.178 1.882
447 1HG2 ILE 54 1HG2 ILE 54 1.193 -5.284 2.326
448 2HG2 ILE 54 2HG2 ILE 54 2.468 -4.071 2.208
449 3HG2 ILE 54 3HG2 ILE 54 1.504 -4.476 0.790
450 1HD1 ILE 54 1HD1 ILE 54 2.197 -1.317 3.199
451 2HD1 ILE 54 2HD1 ILE 54 2.479 -0.491 1.666
452 3HD1 ILE 54 3HD1 ILE 54 2.999 -2.164 1.877
453 H THR 55 H THR 55 -1.332 -3.813 4.242
454 HA THR 55 HA THR 55 -1.256 -6.473 4.854
455 HB THR 55 HB THR 55 -3.297 -4.636 6.092
456 HG1 THR 55 1HG THR 55 -1.534 -3.347 6.187
457 1HG2 THR 55 1HG2 THR 55 -2.688 -5.832 8.132
458 2HG2 THR 55 2HG2 THR 55 -1.499 -6.776 7.233
459 3HG2 THR 55 3HG2 THR 55 -3.219 -6.960 6.882
460 H ARG 56 H ARG 56 -4.029 -4.665 3.575
461 HA ARG 56 HA ARG 56 -5.922 -6.747 3.791
462 1HB ARG 56 2HB ARG 56 -6.571 -4.405 3.462
463 2HB ARG 56 1HB ARG 56 -5.851 -4.423 1.857
464 1HG ARG 56 2HG ARG 56 -7.461 -6.126 1.160
465 2HG ARG 56 1HG ARG 56 -8.194 -6.081 2.766
466 1HD ARG 56 2HD ARG 56 -8.770 -3.734 2.443
467 2HD ARG 56 1HD ARG 56 -8.007 -3.760 0.851
468 HE ARG 56 HE ARG 56 -9.955 -5.792 0.992
469 1HH1 ARG 56 1HH1 ARG 56 -9.748 -2.284 0.853
470 2HH1 ARG 56 2HH1 ARG 56 -11.269 -2.115 0.028
471 1HH2 ARG 56 1HH2 ARG 56 -11.921 -5.556 -0.081
472 2HH2 ARG 56 2HH2 ARG 56 -12.506 -3.977 -0.509
473 H ILE 57 H ILE 57 -3.890 -5.693 1.053
474 HA ILE 57 HA ILE 57 -4.792 -7.585 -0.807
475 HB ILE 57 HB ILE 57 -2.044 -6.335 -0.584
476 1HG1 ILE 57 2HG1 ILE 57 -4.444 -5.550 -2.257
477 2HG1 ILE 57 1HG1 ILE 57 -3.894 -4.708 -0.813
478 1HG2 ILE 57 1HG2 ILE 57 -3.351 -7.796 -2.877
479 2HG2 ILE 57 2HG2 ILE 57 -1.923 -8.302 -1.971
480 3HG2 ILE 57 3HG2 ILE 57 -1.854 -6.869 -2.996
481 1HD1 ILE 57 1HD1 ILE 57 -3.194 -3.550 -2.822
482 2HD1 ILE 57 2HD1 ILE 57 -2.357 -4.997 -3.383
483 3HD1 ILE 57 3HD1 ILE 57 -1.796 -4.160 -1.936
484 H ILE 58 H ILE 58 -2.191 -7.742 1.579
485 HA ILE 58 HA ILE 58 -1.124 -10.228 0.818
486 HB ILE 58 HB ILE 58 -1.105 -8.829 3.489
487 1HG1 ILE 58 2HG1 ILE 58 0.984 -9.069 1.316
488 2HG1 ILE 58 1HG1 ILE 58 0.031 -7.633 1.672
489 1HG2 ILE 58 1HG2 ILE 58 0.713 -10.323 4.124
490 2HG2 ILE 58 2HG2 ILE 58 0.516 -11.209 2.613
491 3HG2 ILE 58 3HG2 ILE 58 -0.774 -11.219 3.815
492 1HD1 ILE 58 1HD1 ILE 58 1.071 -7.501 3.881
493 2HD1 ILE 58 2HD1 ILE 58 2.262 -7.434 2.582
494 3HD1 ILE 58 3HD1 ILE 58 2.040 -8.923 3.501
495 H SER 59 H SER 59 -3.571 -9.427 3.283
496 HA SER 59 HA SER 59 -3.792 -12.058 4.283
497 1HB SER 59 2HB SER 59 -6.018 -11.142 5.219
498 2HB SER 59 1HB SER 59 -4.517 -10.387 5.751
499 HG SER 59 HG SER 59 -4.907 -8.669 4.421
500 H GLN 60 H GLN 60 -5.399 -10.405 1.650
501 HA GLN 60 HA GLN 60 -7.330 -12.538 1.300
502 1HB GLN 60 2HB GLN 60 -6.719 -10.069 -0.328
503 2HB GLN 60 1HB GLN 60 -7.967 -11.233 -0.753
504 1HG GLN 60 2HG GLN 60 -7.848 -9.571 1.752
505 2HG GLN 60 1HG GLN 60 -8.938 -9.342 0.384
506 1HE2 GLN 60 1HE2 GLN 60 -9.553 -9.828 3.192
507 2HE2 GLN 60 2HE2 GLN 60 -10.507 -11.274 3.237
508 H GLN 61 H GLN 61 -4.148 -11.874 0.297
509 HA GLN 61 HA GLN 61 -4.212 -13.215 -2.229
510 1HB GLN 61 2HB GLN 61 -2.545 -11.443 -1.453
511 2HB GLN 61 1HB GLN 61 -1.783 -12.711 -0.508
512 1HG GLN 61 2HG GLN 61 -2.183 -13.012 -3.458
513 2HG GLN 61 1HG GLN 61 -0.813 -12.122 -2.806
514 1HE2 GLN 61 1HE2 GLN 61 -0.580 -13.867 -0.480
515 2HE2 GLN 61 2HE2 GLN 61 0.105 -15.349 -1.048
516 H LYS 62 H LYS 62 -3.473 -14.113 1.076
517 HA LYS 62 HA LYS 62 -2.414 -16.693 0.405
518 1HB LYS 62 2HB LYS 62 -1.707 -15.469 2.421
519 2HB LYS 62 1HB LYS 62 -3.337 -15.595 3.064
520 1HG LYS 62 2HG LYS 62 -3.144 -17.983 3.233
521 2HG LYS 62 1HG LYS 62 -1.570 -17.947 2.432
522 1HD LYS 62 2HD LYS 62 -0.637 -16.669 4.272
523 2HD LYS 62 1HD LYS 62 -2.212 -16.615 5.062
524 1HE LYS 62 2HE LYS 62 -0.784 -18.302 6.074
525 2HE LYS 62 1HE LYS 62 -2.180 -19.044 5.297
526 1HZ LYS 62 1HZ LYS 62 0.468 -18.840 3.981
527 2HZ LYS 62 2HZ LYS 62 -0.856 -19.788 3.511
528 3HZ LYS 62 3HZ LYS 62 0.007 -20.169 4.921
Start of MODEL 2
1 1H MET 1 1HT MET 1 -15.260 11.740 -17.435
2 2H MET 1 2HT MET 1 -16.257 11.387 -18.759
3 3H MET 1 3HT MET 1 -14.582 11.509 -18.974
4 HA MET 1 HA MET 1 -15.940 9.471 -17.306
5 1HB MET 1 2HB MET 1 -14.774 9.283 -20.090
6 2HB MET 1 1HB MET 1 -15.204 7.889 -19.112
7 1HG MET 1 2HG MET 1 -16.957 8.298 -20.675
8 2HG MET 1 1HG MET 1 -17.543 8.707 -19.063
9 1HE MET 1 1HE MET 1 -18.967 9.575 -21.805
10 2HE MET 1 2HE MET 1 -19.403 11.242 -21.435
11 3HE MET 1 3HE MET 1 -19.607 9.986 -20.214
12 H GLY 2 H GLY 2 -14.640 8.638 -15.838
13 1HA GLY 2 2HA GLY 2 -11.764 8.449 -16.465
14 2HA GLY 2 1HA GLY 2 -12.283 9.140 -14.932
15 H ASN 3 H ASN 3 -13.872 6.473 -16.542
16 HA ASN 3 HA ASN 3 -14.031 4.929 -14.205
17 1HB ASN 3 2HB ASN 3 -14.942 3.173 -15.641
18 2HB ASN 3 1HB ASN 3 -15.618 4.737 -16.082
19 1HD2 ASN 3 1HD2 ASN 3 -13.727 2.057 -17.110
20 2HD2 ASN 3 2HD2 ASN 3 -13.478 2.584 -18.737
21 H ILE 4 H ILE 4 -11.605 5.049 -16.702
22 HA ILE 4 HA ILE 4 -10.378 2.562 -15.866
23 HB ILE 4 HB ILE 4 -10.330 3.228 -18.245
24 1HG1 ILE 4 2HG1 ILE 4 -7.908 2.813 -18.643
25 2HG1 ILE 4 1HG1 ILE 4 -7.610 3.064 -16.926
26 1HG2 ILE 4 1HG2 ILE 4 -10.158 5.626 -17.992
27 2HG2 ILE 4 2HG2 ILE 4 -8.824 5.028 -18.980
28 3HG2 ILE 4 3HG2 ILE 4 -8.547 5.464 -17.293
29 1HD1 ILE 4 1HD1 ILE 4 -7.684 0.705 -17.462
30 2HD1 ILE 4 2HD1 ILE 4 -9.307 0.889 -18.127
31 3HD1 ILE 4 3HD1 ILE 4 -9.025 1.145 -16.405
32 H ARG 5 H ARG 5 -10.188 5.887 -15.071
33 HA ARG 5 HA ARG 5 -7.555 5.593 -13.859
34 1HB ARG 5 2HB ARG 5 -9.325 7.983 -14.343
35 2HB ARG 5 1HB ARG 5 -7.899 8.066 -13.316
36 1HG ARG 5 2HG ARG 5 -6.498 7.370 -15.183
37 2HG ARG 5 1HG ARG 5 -7.920 7.259 -16.217
38 1HD ARG 5 2HD ARG 5 -7.025 9.783 -14.839
39 2HD ARG 5 1HD ARG 5 -6.592 9.354 -16.493
40 HE ARG 5 HE ARG 5 -9.359 9.827 -15.567
41 1HH1 ARG 5 1HH1 ARG 5 -6.838 10.054 -17.990
42 2HH1 ARG 5 2HH1 ARG 5 -7.884 10.731 -19.200
43 1HH2 ARG 5 1HH2 ARG 5 -10.725 10.760 -17.144
44 2HH2 ARG 5 2HH2 ARG 5 -10.090 11.168 -18.709
45 H THR 6 H THR 6 -7.802 4.386 -12.114
46 HA THR 6 HA THR 6 -9.015 5.481 -9.771
47 HB THR 6 HB THR 6 -11.055 4.591 -10.711
48 HG1 THR 6 1HG THR 6 -11.367 4.047 -8.686
49 1HG2 THR 6 1HG2 THR 6 -9.581 1.972 -11.006
50 2HG2 THR 6 2HG2 THR 6 -10.125 3.021 -12.313
51 3HG2 THR 6 3HG2 THR 6 -11.308 2.212 -11.288
52 H SER 7 H SER 7 -7.158 3.163 -11.464
53 HA SER 7 HA SER 7 -6.482 1.490 -9.264
54 1HB SER 7 2HB SER 7 -4.968 1.832 -11.855
55 2HB SER 7 1HB SER 7 -4.974 0.427 -10.788
56 HG SER 7 HG SER 7 -6.561 -0.248 -11.979
57 H PHE 8 H PHE 8 -5.776 4.628 -9.501
58 HA PHE 8 HA PHE 8 -2.959 4.766 -9.383
59 1HB PHE 8 2HB PHE 8 -5.084 6.672 -8.406
60 2HB PHE 8 1HB PHE 8 -3.361 7.032 -8.338
61 HD1 PHE 8 1HD PHE 8 -6.256 6.590 -10.528
62 HD2 PHE 8 2HD PHE 8 -2.104 7.492 -10.343
63 HE1 PHE 8 1HE PHE 8 -6.335 7.418 -12.841
64 HE2 PHE 8 2HE PHE 8 -2.175 8.327 -12.655
65 HZ PHE 8 HZ PHE 8 -4.295 8.288 -13.908
66 H VAL 9 H VAL 9 -5.414 4.627 -6.820
67 HA VAL 9 HA VAL 9 -3.683 4.752 -4.620
68 HB VAL 9 HB VAL 9 -6.290 3.234 -4.879
69 1HG1 VAL 9 1HG1 VAL 9 -4.809 4.100 -2.394
70 2HG1 VAL 9 2HG1 VAL 9 -4.994 2.442 -2.964
71 3HG1 VAL 9 3HG1 VAL 9 -6.407 3.356 -2.436
72 1HG2 VAL 9 1HG2 VAL 9 -7.287 5.202 -3.820
73 2HG2 VAL 9 2HG2 VAL 9 -6.518 5.615 -5.352
74 3HG2 VAL 9 3HG2 VAL 9 -5.717 6.005 -3.830
75 H LYS 10 H LYS 10 -4.926 1.942 -6.382
76 HA LYS 10 HA LYS 10 -3.528 -0.033 -4.939
77 1HB LYS 10 2HB LYS 10 -5.490 -0.381 -6.473
78 2HB LYS 10 1HB LYS 10 -4.399 -0.160 -7.830
79 1HG LYS 10 2HG LYS 10 -3.148 -2.125 -7.192
80 2HG LYS 10 1HG LYS 10 -4.142 -2.317 -5.747
81 1HD LYS 10 2HD LYS 10 -6.130 -2.561 -7.203
82 2HD LYS 10 1HD LYS 10 -5.067 -2.499 -8.609
83 1HE LYS 10 2HE LYS 10 -3.922 -4.507 -7.843
84 2HE LYS 10 1HE LYS 10 -4.938 -4.553 -6.404
85 1HZ LYS 10 1HZ LYS 10 -5.749 -6.083 -8.070
86 2HZ LYS 10 2HZ LYS 10 -5.874 -4.834 -9.210
87 3HZ LYS 10 3HZ LYS 10 -6.875 -4.838 -7.839
88 H ARG 11 H ARG 11 -2.630 2.002 -7.638
89 HA ARG 11 HA ARG 11 -0.273 0.685 -8.439
90 1HB ARG 11 2HB ARG 11 -1.324 2.474 -9.761
91 2HB ARG 11 1HB ARG 11 -0.937 3.639 -8.503
92 1HG ARG 11 2HG ARG 11 0.755 4.038 -9.982
93 2HG ARG 11 1HG ARG 11 1.522 2.838 -8.941
94 1HD ARG 11 2HD ARG 11 0.241 2.370 -11.628
95 2HD ARG 11 1HD ARG 11 1.959 2.300 -11.246
96 HE ARG 11 HE ARG 11 0.323 0.450 -9.753
97 1HH1 ARG 11 1HH1 ARG 11 2.263 0.982 -12.624
98 2HH1 ARG 11 2HH1 ARG 11 2.434 -0.716 -12.965
99 1HH2 ARG 11 1HH2 ARG 11 0.552 -1.764 -10.187
100 2HH2 ARG 11 2HH2 ARG 11 1.501 -2.281 -11.551
101 H ILE 12 H ILE 12 -0.749 3.413 -6.210
102 HA ILE 12 HA ILE 12 1.910 3.780 -5.455
103 HB ILE 12 HB ILE 12 -0.573 4.257 -3.793
104 1HG1 ILE 12 2HG1 ILE 12 0.964 6.149 -5.589
105 2HG1 ILE 12 1HG1 ILE 12 -0.570 5.392 -6.006
106 1HG2 ILE 12 1HG2 ILE 12 0.774 5.861 -2.554
107 2HG2 ILE 12 2HG2 ILE 12 2.183 5.464 -3.537
108 3HG2 ILE 12 3HG2 ILE 12 1.491 4.252 -2.457
109 1HD1 ILE 12 1HD1 ILE 12 -0.095 7.333 -3.754
110 2HD1 ILE 12 2HD1 ILE 12 -1.629 6.543 -4.120
111 3HD1 ILE 12 3HD1 ILE 12 -0.918 7.665 -5.281
112 H ALA 13 H ALA 13 -0.603 1.740 -4.035
113 HA ALA 13 HA ALA 13 0.899 0.833 -1.827
114 1HB ALA 13 1HB ALA 13 -1.393 -0.547 -3.220
115 2HB ALA 13 2HB ALA 13 -1.549 0.672 -1.955
116 3HB ALA 13 3HB ALA 13 -0.802 -0.885 -1.592
117 H LYS 14 H LYS 14 0.286 -0.635 -5.016
118 HA LYS 14 HA LYS 14 1.777 -2.978 -4.508
119 1HB LYS 14 2HB LYS 14 0.088 -2.841 -6.282
120 2HB LYS 14 1HB LYS 14 1.092 -1.695 -7.161
121 1HG LYS 14 2HG LYS 14 2.749 -3.359 -7.577
122 2HG LYS 14 1HG LYS 14 1.954 -4.499 -6.492
123 1HD LYS 14 2HD LYS 14 0.019 -4.570 -7.986
124 2HD LYS 14 1HD LYS 14 0.809 -3.421 -9.065
125 1HE LYS 14 2HE LYS 14 2.028 -6.069 -8.328
126 2HE LYS 14 1HE LYS 14 0.947 -5.872 -9.707
127 1HZ LYS 14 1HZ LYS 14 3.291 -5.737 -10.330
128 2HZ LYS 14 2HZ LYS 14 3.498 -4.394 -9.321
129 3HZ LYS 14 3HZ LYS 14 2.474 -4.294 -10.667
130 H GLU 15 H GLU 15 2.643 0.086 -6.084
131 HA GLU 15 HA GLU 15 5.237 -0.658 -6.875
132 1HB GLU 15 2HB GLU 15 4.032 1.343 -7.711
133 2HB GLU 15 1HB GLU 15 4.228 2.099 -6.136
134 1HG GLU 15 2HG GLU 15 6.676 1.981 -6.428
135 2HG GLU 15 1HG GLU 15 6.422 1.332 -8.047
136 H MET 16 H MET 16 3.979 0.729 -3.899
137 HA MET 16 HA MET 16 6.338 1.369 -2.555
138 1HB MET 16 2HB MET 16 3.868 1.745 -1.897
139 2HB MET 16 1HB MET 16 3.954 0.140 -1.187
140 1HG MET 16 2HG MET 16 4.329 1.849 0.484
141 2HG MET 16 1HG MET 16 5.777 0.870 0.255
142 1HE MET 16 1HE MET 16 4.024 4.242 -0.863
143 2HE MET 16 2HE MET 16 4.616 3.521 -2.358
144 3HE MET 16 3HE MET 16 5.345 5.005 -1.743
145 H ILE 17 H ILE 17 4.523 -1.686 -2.608
146 HA ILE 17 HA ILE 17 6.435 -3.078 -0.985
147 HB ILE 17 HB ILE 17 4.257 -4.243 -2.721
148 1HG1 ILE 17 2HG1 ILE 17 4.175 -3.511 0.215
149 2HG1 ILE 17 1HG1 ILE 17 3.389 -2.606 -1.078
150 1HG2 ILE 17 1HG2 ILE 17 5.770 -5.391 -0.376
151 2HG2 ILE 17 2HG2 ILE 17 5.930 -5.874 -2.065
152 3HG2 ILE 17 3HG2 ILE 17 4.419 -6.170 -1.203
153 1HD1 ILE 17 1HD1 ILE 17 2.770 -5.406 -0.177
154 2HD1 ILE 17 2HD1 ILE 17 2.062 -4.638 -1.597
155 3HD1 ILE 17 3HD1 ILE 17 1.761 -3.970 0.005
156 H GLU 18 H GLU 18 5.585 -3.125 -4.432
157 HA GLU 18 HA GLU 18 7.090 -5.400 -5.070
158 1HB GLU 18 2HB GLU 18 5.223 -4.615 -6.417
159 2HB GLU 18 1HB GLU 18 6.122 -3.168 -6.850
160 1HG GLU 18 2HG GLU 18 7.661 -4.400 -8.149
161 2HG GLU 18 1HG GLU 18 7.061 -5.939 -7.527
162 H THR 19 H THR 19 8.047 -2.059 -4.850
163 HA THR 19 HA THR 19 10.382 -2.150 -6.400
164 HB THR 19 HB THR 19 11.148 -0.349 -4.656
165 HG1 THR 19 1HG THR 19 8.384 -0.142 -4.170
166 1HG2 THR 19 1HG2 THR 19 10.404 0.138 -6.942
167 2HG2 THR 19 2HG2 THR 19 9.775 1.328 -5.802
168 3HG2 THR 19 3HG2 THR 19 8.725 0.053 -6.415
169 H HIS 20 H HIS 20 9.651 -3.472 -3.292
170 HA HIS 20 HA HIS 20 12.234 -4.793 -3.332
171 1HB HIS 20 2HB HIS 20 12.712 -4.391 -0.973
172 2HB HIS 20 1HB HIS 20 12.619 -2.870 -1.843
173 HD1 HIS 20 1HD HIS 20 10.037 -1.720 -1.577
174 HD2 HIS 20 2HD HIS 20 11.400 -4.329 1.356
175 HE1 HIS 20 1HE HIS 20 8.648 -1.233 0.460
176 HE2 HIS 20 2HE HIS 20 9.587 -2.736 2.262
177 HA PRO 21 HA PRO 21 8.718 -7.606 -2.911
178 1HB PRO 21 2HB PRO 21 9.991 -9.768 -3.962
179 2HB PRO 21 1HB PRO 21 9.275 -8.487 -4.951
180 1HG PRO 21 2HG PRO 21 12.130 -8.886 -4.138
181 2HG PRO 21 1HG PRO 21 11.469 -8.428 -5.720
182 1HD PRO 21 2HD PRO 21 12.528 -6.608 -4.030
183 2HD PRO 21 1HD PRO 21 11.163 -6.226 -5.099
184 H GLY 22 H GLY 22 8.316 -9.609 -1.796
185 1HA GLY 22 2HA GLY 22 9.542 -11.427 -0.504
186 2HA GLY 22 1HA GLY 22 10.255 -10.079 0.371
187 H LYS 23 H LYS 23 8.385 -8.442 1.062
188 HA LYS 23 HA LYS 23 6.812 -8.050 2.648
189 1HB LYS 23 2HB LYS 23 5.540 -10.592 1.596
190 2HB LYS 23 1HB LYS 23 4.768 -9.442 2.673
191 1HG LYS 23 2HG LYS 23 5.098 -7.715 0.847
192 2HG LYS 23 1HG LYS 23 5.526 -9.065 -0.209
193 1HD LYS 23 2HD LYS 23 3.353 -10.124 0.348
194 2HD LYS 23 1HD LYS 23 2.927 -8.688 1.278
195 1HE LYS 23 2HE LYS 23 1.886 -8.440 -0.826
196 2HE LYS 23 1HE LYS 23 3.280 -7.365 -0.844
197 1HZ LYS 23 1HZ LYS 23 2.899 -8.774 -2.892
198 2HZ LYS 23 2HZ LYS 23 3.390 -10.103 -1.960
199 3HZ LYS 23 3HZ LYS 23 4.464 -8.818 -2.235
200 H PHE 24 H PHE 24 5.370 -9.982 4.263
201 HA PHE 24 HA PHE 24 7.309 -11.775 5.396
202 1HB PHE 24 2HB PHE 24 7.942 -9.523 6.332
203 2HB PHE 24 1HB PHE 24 6.364 -9.469 7.110
204 HD1 PHE 24 1HD PHE 24 6.136 -10.282 9.256
205 HD2 PHE 24 2HD PHE 24 9.395 -11.614 6.862
206 HE1 PHE 24 1HE PHE 24 7.058 -11.494 11.189
207 HE2 PHE 24 2HE PHE 24 10.319 -12.827 8.791
208 HZ PHE 24 HZ PHE 24 9.150 -12.770 10.957
209 H THR 25 H THR 25 4.571 -9.992 6.804
210 HA THR 25 HA THR 25 2.811 -12.279 6.551
211 HB THR 25 HB THR 25 3.551 -11.218 9.299
212 HG1 THR 25 1HG THR 25 4.665 -13.153 7.748
213 1HG2 THR 25 1HG2 THR 25 2.195 -13.083 10.144
214 2HG2 THR 25 2HG2 THR 25 1.762 -13.514 8.488
215 3HG2 THR 25 3HG2 THR 25 1.229 -11.977 9.164
216 H ASP 26 H ASP 26 0.556 -11.668 7.260
217 HA ASP 26 HA ASP 26 0.043 -8.939 6.519
218 1HB ASP 26 2HB ASP 26 -2.350 -9.563 6.755
219 2HB ASP 26 1HB ASP 26 -1.455 -10.636 5.689
220 H ASP 27 H ASP 27 1.314 -8.134 8.340
221 HA ASP 27 HA ASP 27 -0.447 -7.578 10.615
222 1HB ASP 27 2HB ASP 27 1.188 -9.317 11.317
223 2HB ASP 27 1HB ASP 27 2.501 -8.233 10.867
224 H PHE 28 H PHE 28 0.148 -5.583 11.736
225 HA PHE 28 HA PHE 28 0.515 -3.503 9.889
226 1HB PHE 28 2HB PHE 28 0.621 -3.432 12.909
227 2HB PHE 28 1HB PHE 28 0.513 -2.014 11.868
228 HD1 PHE 28 1HD PHE 28 -1.296 -4.627 13.523
229 HD2 PHE 28 2HD PHE 28 -1.509 -1.759 10.385
230 HE1 PHE 28 1HE PHE 28 -3.746 -4.845 13.498
231 HE2 PHE 28 2HE PHE 28 -3.962 -1.966 10.360
232 HZ PHE 28 HZ PHE 28 -5.082 -3.512 11.912
233 H ASP 29 H ASP 29 2.750 -5.194 11.948
234 HA ASP 29 HA ASP 29 4.907 -3.405 11.892
235 1HB ASP 29 2HB ASP 29 4.919 -5.316 13.363
236 2HB ASP 29 1HB ASP 29 4.824 -6.424 12.000
237 H THR 30 H THR 30 3.938 -5.959 9.656
238 HA THR 30 HA THR 30 6.207 -5.804 7.987
239 HB THR 30 HB THR 30 3.449 -6.857 7.352
240 HG1 THR 30 1HG THR 30 5.269 -7.724 9.051
241 1HG2 THR 30 1HG2 THR 30 4.782 -6.427 5.327
242 2HG2 THR 30 2HG2 THR 30 4.562 -8.157 5.603
243 3HG2 THR 30 3HG2 THR 30 6.099 -7.390 5.999
244 H ASN 31 H ASN 31 2.902 -4.455 7.573
245 HA ASN 31 HA ASN 31 3.519 -3.265 5.077
246 1HB ASN 31 2HB ASN 31 1.446 -1.966 5.329
247 2HB ASN 31 1HB ASN 31 1.200 -3.674 5.661
248 1HD2 ASN 31 1HD2 ASN 31 1.456 -0.487 7.088
249 2HD2 ASN 31 2HD2 ASN 31 0.654 -0.891 8.562
250 H LYS 32 H LYS 32 3.936 -2.210 8.362
251 HA LYS 32 HA LYS 32 4.344 0.531 7.929
252 1HB LYS 32 2HB LYS 32 4.142 -0.622 10.165
253 2HB LYS 32 1HB LYS 32 5.792 -1.193 9.952
254 1HG LYS 32 2HG LYS 32 6.537 1.159 9.801
255 2HG LYS 32 1HG LYS 32 4.882 1.665 10.155
256 1HD LYS 32 2HD LYS 32 5.010 0.372 12.277
257 2HD LYS 32 1HD LYS 32 6.714 0.059 11.936
258 1HE LYS 32 2HE LYS 32 5.402 2.742 12.341
259 2HE LYS 32 1HE LYS 32 6.526 1.938 13.435
260 1HZ LYS 32 1HZ LYS 32 7.606 3.672 12.127
261 2HZ LYS 32 2HZ LYS 32 7.177 2.887 10.688
262 3HZ LYS 32 3HZ LYS 32 8.261 2.150 11.773
263 H LYS 33 H LYS 33 6.631 -2.182 7.963
264 HA LYS 33 HA LYS 33 8.935 -0.676 7.366
265 1HB LYS 33 2HB LYS 33 8.360 -3.587 6.783
266 2HB LYS 33 1HB LYS 33 9.951 -2.841 6.761
267 1HG LYS 33 2HG LYS 33 9.825 -2.399 9.127
268 2HG LYS 33 1HG LYS 33 8.168 -3.003 9.182
269 1HD LYS 33 2HD LYS 33 9.642 -4.716 10.001
270 2HD LYS 33 1HD LYS 33 9.016 -5.218 8.429
271 1HE LYS 33 2HE LYS 33 11.365 -5.711 8.524
272 2HE LYS 33 1HE LYS 33 11.104 -4.391 7.387
273 1HZ LYS 33 1HZ LYS 33 13.008 -3.969 8.803
274 2HZ LYS 33 2HZ LYS 33 12.048 -4.105 10.192
275 3HZ LYS 33 3HZ LYS 33 11.794 -2.826 9.106
276 H LEU 34 H LEU 34 6.479 -2.140 5.345
277 HA LEU 34 HA LEU 34 7.900 -1.981 2.897
278 1HB LEU 34 2HB LEU 34 4.932 -2.115 3.435
279 2HB LEU 34 1HB LEU 34 5.663 -2.303 1.853
280 HG LEU 34 HG LEU 34 6.129 -4.140 4.207
281 1HD1 LEU 34 1HD1 LEU 34 4.808 -5.758 2.935
282 2HD1 LEU 34 2HD1 LEU 34 4.477 -4.530 1.715
283 3HD1 LEU 34 3HD1 LEU 34 3.857 -4.333 3.354
284 1HD2 LEU 34 1HD2 LEU 34 6.984 -4.375 1.323
285 2HD2 LEU 34 2HD2 LEU 34 7.245 -5.578 2.585
286 3HD2 LEU 34 3HD2 LEU 34 8.044 -4.011 2.684
287 H VAL 35 H VAL 35 5.575 0.173 4.486
288 HA VAL 35 HA VAL 35 5.450 1.947 2.230
289 HB VAL 35 HB VAL 35 4.435 2.388 5.046
290 1HG1 VAL 35 1HG1 VAL 35 2.946 4.043 3.954
291 2HG1 VAL 35 2HG1 VAL 35 3.855 3.823 2.459
292 3HG1 VAL 35 3HG1 VAL 35 4.653 4.483 3.887
293 1HG2 VAL 35 1HG2 VAL 35 3.431 0.420 4.004
294 2HG2 VAL 35 2HG2 VAL 35 2.996 1.380 2.590
295 3HG2 VAL 35 3HG2 VAL 35 2.255 1.727 4.154
296 H GLU 36 H GLU 36 6.990 2.066 5.439
297 HA GLU 36 HA GLU 36 7.997 4.669 5.287
298 1HB GLU 36 2HB GLU 36 8.562 2.278 6.894
299 2HB GLU 36 1HB GLU 36 9.929 3.368 6.717
300 1HG GLU 36 2HG GLU 36 8.874 4.055 8.669
301 2HG GLU 36 1HG GLU 36 8.348 5.214 7.451
302 H GLU 37 H GLU 37 8.966 1.858 3.602
303 HA GLU 37 HA GLU 37 11.725 2.372 3.348
304 1HB GLU 37 2HB GLU 37 10.524 0.181 2.923
305 2HB GLU 37 1HB GLU 37 10.022 0.852 1.376
306 1HG GLU 37 2HG GLU 37 11.924 -0.477 0.953
307 2HG GLU 37 1HG GLU 37 12.451 1.203 0.852
308 H PHE 38 H PHE 38 8.945 3.357 1.379
309 HA PHE 38 HA PHE 38 10.828 4.887 -0.288
310 1HB PHE 38 2HB PHE 38 8.463 3.251 -1.188
311 2HB PHE 38 1HB PHE 38 9.184 4.503 -2.197
312 HD1 PHE 38 1HD PHE 38 11.365 4.213 -3.172
313 HD2 PHE 38 2HD PHE 38 9.660 1.201 -0.701
314 HE1 PHE 38 1HE PHE 38 13.059 2.610 -3.958
315 HE2 PHE 38 2HE PHE 38 11.350 -0.404 -1.483
316 HZ PHE 38 HZ PHE 38 13.056 0.300 -3.113
317 H SER 39 H SER 39 7.365 4.662 0.565
318 HA SER 39 HA SER 39 6.527 7.132 -0.283
319 1HB SER 39 2HB SER 39 5.083 5.357 0.727
320 2HB SER 39 1HB SER 39 5.659 5.854 2.316
321 HG SER 39 HG SER 39 3.624 6.815 1.585
322 H THR 40 H THR 40 7.464 9.023 0.010
323 HA THR 40 HA THR 40 8.259 9.806 2.735
324 HB THR 40 HB THR 40 10.245 9.470 1.323
325 HG1 THR 40 1HG THR 40 9.858 11.453 2.832
326 1HG2 THR 40 1HG2 THR 40 9.044 11.598 -0.449
327 2HG2 THR 40 2HG2 THR 40 9.282 9.901 -0.866
328 3HG2 THR 40 3HG2 THR 40 10.677 10.949 -0.599
329 H VAL 41 H VAL 41 5.869 10.143 0.780
330 HA VAL 41 HA VAL 41 5.719 13.016 0.452
331 HB VAL 41 HB VAL 41 4.838 11.304 -1.207
332 1HG1 VAL 41 1HG1 VAL 41 2.648 11.035 0.837
333 2HG1 VAL 41 2HG1 VAL 41 3.737 9.771 0.264
334 3HG1 VAL 41 3HG1 VAL 41 2.548 10.471 -0.833
335 1HG2 VAL 41 1HG2 VAL 41 4.265 13.649 -1.398
336 2HG2 VAL 41 2HG2 VAL 41 2.931 13.437 -0.266
337 3HG2 VAL 41 3HG2 VAL 41 2.884 12.642 -1.837
338 H SER 42 H SER 42 2.968 13.438 1.025
339 HA SER 42 HA SER 42 2.906 14.216 3.640
340 1HB SER 42 2HB SER 42 0.497 13.241 2.089
341 2HB SER 42 1HB SER 42 0.515 14.432 3.392
342 HG SER 42 HG SER 42 0.728 15.822 1.830
343 H THR 43 H THR 43 3.240 13.054 5.388
344 HA THR 43 HA THR 43 2.830 10.187 5.325
345 HB THR 43 HB THR 43 4.024 11.884 7.508
346 HG1 THR 43 1HG THR 43 4.937 11.353 5.013
347 1HG2 THR 43 1HG2 THR 43 3.472 9.605 8.192
348 2HG2 THR 43 2HG2 THR 43 5.219 9.832 8.115
349 3HG2 THR 43 3HG2 THR 43 4.384 8.966 6.825
350 H LYS 44 H LYS 44 1.625 12.988 7.057
351 HA LYS 44 HA LYS 44 0.876 12.352 9.458
352 1HB LYS 44 2HB LYS 44 -1.131 13.555 7.556
353 2HB LYS 44 1HB LYS 44 -1.124 13.726 9.305
354 1HG LYS 44 2HG LYS 44 0.896 14.811 7.358
355 2HG LYS 44 1HG LYS 44 -0.237 15.725 8.354
356 1HD LYS 44 2HD LYS 44 1.943 13.961 9.471
357 2HD LYS 44 1HD LYS 44 2.126 15.695 9.198
358 1HE LYS 44 2HE LYS 44 -0.017 14.486 10.942
359 2HE LYS 44 1HE LYS 44 1.541 15.046 11.552
360 1HZ LYS 44 1HZ LYS 44 0.013 16.799 11.862
361 2HZ LYS 44 2HZ LYS 44 -0.601 16.662 10.288
362 3HZ LYS 44 3HZ LYS 44 0.972 17.251 10.536
363 H HIS 45 H HIS 45 -1.962 11.907 7.376
364 HA HIS 45 HA HIS 45 -2.162 9.169 8.428
365 1HB HIS 45 2HB HIS 45 -4.153 11.344 8.614
366 2HB HIS 45 1HB HIS 45 -4.782 9.760 8.169
367 HD1 HIS 45 1HD HIS 45 -5.694 8.686 10.205
368 HD2 HIS 45 2HD HIS 45 -2.167 10.754 10.995
369 HE1 HIS 45 1HE HIS 45 -5.166 8.242 12.622
370 HE2 HIS 45 2HE HIS 45 -2.933 9.330 13.015
371 H LEU 46 H LEU 46 -1.706 10.899 5.765
372 HA LEU 46 HA LEU 46 -3.467 9.621 3.905
373 1HB LEU 46 2HB LEU 46 -2.315 11.770 3.447
374 2HB LEU 46 1HB LEU 46 -0.778 10.926 3.434
375 HG LEU 46 HG LEU 46 -1.565 9.603 1.476
376 1HD1 LEU 46 1HD1 LEU 46 -3.538 10.403 0.253
377 2HD1 LEU 46 2HD1 LEU 46 -3.917 11.483 1.594
378 3HD1 LEU 46 3HD1 LEU 46 -3.954 9.735 1.830
379 1HD2 LEU 46 1HD2 LEU 46 -1.346 11.412 -0.144
380 2HD2 LEU 46 2HD2 LEU 46 -0.192 11.602 1.178
381 3HD2 LEU 46 3HD2 LEU 46 -1.648 12.595 1.128
382 H ARG 47 H ARG 47 -0.177 9.128 5.007
383 HA ARG 47 HA ARG 47 0.417 6.839 3.470
384 1HB ARG 47 2HB ARG 47 2.280 7.893 4.335
385 2HB ARG 47 1HB ARG 47 1.533 8.169 5.899
386 1HG ARG 47 2HG ARG 47 1.759 5.744 6.375
387 2HG ARG 47 1HG ARG 47 2.644 5.579 4.856
388 1HD ARG 47 2HD ARG 47 4.453 6.771 5.618
389 2HD ARG 47 1HD ARG 47 3.506 7.645 6.817
390 HE ARG 47 HE ARG 47 4.804 5.071 7.128
391 1HH1 ARG 47 1HH1 ARG 47 2.282 7.199 8.330
392 2HH1 ARG 47 2HH1 ARG 47 2.341 6.573 9.940
393 1HH2 ARG 47 1HH2 ARG 47 4.929 4.276 9.260
394 2HH2 ARG 47 2HH2 ARG 47 3.863 4.917 10.479
395 H ASN 48 H ASN 48 -1.067 7.298 6.633
396 HA ASN 48 HA ASN 48 -1.052 4.638 7.512
397 1HB ASN 48 2HB ASN 48 -3.031 6.855 8.084
398 2HB ASN 48 1HB ASN 48 -3.002 5.315 8.935
399 1HD2 ASN 48 1HD2 ASN 48 -2.609 6.279 10.904
400 2HD2 ASN 48 2HD2 ASN 48 -1.090 6.999 11.318
401 H LYS 49 H LYS 49 -3.334 6.418 5.512
402 HA LYS 49 HA LYS 49 -5.321 4.443 5.297
403 1HB LYS 49 2HB LYS 49 -5.371 6.918 4.573
404 2HB LYS 49 1HB LYS 49 -4.593 6.367 3.098
405 1HG LYS 49 2HG LYS 49 -6.924 6.526 2.674
406 2HG LYS 49 1HG LYS 49 -6.511 4.809 2.752
407 1HD LYS 49 2HD LYS 49 -7.334 4.692 5.034
408 2HD LYS 49 1HD LYS 49 -7.682 6.421 5.019
409 1HE LYS 49 2HE LYS 49 -9.306 6.055 3.204
410 2HE LYS 49 1HE LYS 49 -8.972 4.324 3.276
411 1HZ LYS 49 1HZ LYS 49 -9.747 4.313 5.574
412 2HZ LYS 49 2HZ LYS 49 -10.958 4.869 4.523
413 3HZ LYS 49 3HZ LYS 49 -10.091 5.971 5.479
414 H ILE 50 H ILE 50 -2.510 5.197 3.260
415 HA ILE 50 HA ILE 50 -2.862 3.155 1.360
416 HB ILE 50 HB ILE 50 -0.260 4.391 2.291
417 1HG1 ILE 50 2HG1 ILE 50 -2.056 5.173 -0.015
418 2HG1 ILE 50 1HG1 ILE 50 -1.945 6.041 1.512
419 1HG2 ILE 50 1HG2 ILE 50 0.599 3.744 0.091
420 2HG2 ILE 50 2HG2 ILE 50 -0.926 2.937 -0.265
421 3HG2 ILE 50 3HG2 ILE 50 0.104 2.342 1.035
422 1HD1 ILE 50 1HD1 ILE 50 0.271 5.677 -0.492
423 2HD1 ILE 50 2HD1 ILE 50 0.418 6.511 1.055
424 3HD1 ILE 50 3HD1 ILE 50 -0.648 7.153 -0.195
425 H ALA 51 H ALA 51 -1.132 3.229 4.436
426 HA ALA 51 HA ALA 51 0.120 0.733 4.296
427 1HB ALA 51 1HB ALA 51 0.711 2.397 5.963
428 2HB ALA 51 2HB ALA 51 0.272 0.877 6.745
429 3HB ALA 51 3HB ALA 51 -0.869 2.222 6.726
430 H GLY 52 H GLY 52 -3.132 1.618 5.351
431 1HA GLY 52 2HA GLY 52 -3.884 -0.929 6.328
432 2HA GLY 52 1HA GLY 52 -4.985 0.328 5.783
433 H TYR 53 H TYR 53 -4.015 0.533 3.117
434 HA TYR 53 HA TYR 53 -5.436 -1.602 1.895
435 1HB TYR 53 2HB TYR 53 -5.118 0.758 0.983
436 2HB TYR 53 1HB TYR 53 -3.505 0.249 0.495
437 HD1 TYR 53 1HD TYR 53 -3.179 -1.090 -1.460
438 HD2 TYR 53 2HD TYR 53 -7.112 -0.340 -0.027
439 HE1 TYR 53 1HE TYR 53 -4.106 -2.007 -3.546
440 HE2 TYR 53 2HE TYR 53 -8.050 -1.254 -2.107
441 HH TYR 53 HH TYR 53 -6.269 -3.055 -4.298
442 H ILE 54 H ILE 54 -2.076 -0.989 2.606
443 HA ILE 54 HA ILE 54 -0.870 -2.978 1.049
444 HB ILE 54 HB ILE 54 -0.040 -1.947 3.767
445 1HG1 ILE 54 2HG1 ILE 54 -0.193 -0.239 1.978
446 2HG1 ILE 54 1HG1 ILE 54 1.461 -0.488 2.530
447 1HG2 ILE 54 1HG2 ILE 54 1.559 -3.494 1.733
448 2HG2 ILE 54 2HG2 ILE 54 1.001 -4.106 3.289
449 3HG2 ILE 54 3HG2 ILE 54 2.185 -2.801 3.226
450 1HD1 ILE 54 1HD1 ILE 54 1.349 -0.262 0.116
451 2HD1 ILE 54 2HD1 ILE 54 0.241 -1.633 0.033
452 3HD1 ILE 54 3HD1 ILE 54 1.900 -1.873 0.580
453 H THR 55 H THR 55 -2.047 -3.141 4.423
454 HA THR 55 HA THR 55 -1.435 -5.837 4.829
455 HB THR 55 HB THR 55 -3.830 -5.180 6.252
456 HG1 THR 55 1HG THR 55 -1.936 -3.206 6.800
457 1HG2 THR 55 1HG2 THR 55 -2.311 -5.277 8.171
458 2HG2 THR 55 2HG2 THR 55 -0.926 -5.209 7.081
459 3HG2 THR 55 3HG2 THR 55 -2.004 -6.606 7.053
460 H ARG 56 H ARG 56 -4.214 -4.292 3.324
461 HA ARG 56 HA ARG 56 -5.824 -6.589 3.020
462 1HB ARG 56 2HB ARG 56 -5.640 -4.036 1.431
463 2HB ARG 56 1HB ARG 56 -6.805 -5.298 1.058
464 1HG ARG 56 2HG ARG 56 -7.793 -5.070 3.263
465 2HG ARG 56 1HG ARG 56 -6.595 -3.846 3.687
466 1HD ARG 56 2HD ARG 56 -8.758 -2.867 3.052
467 2HD ARG 56 1HD ARG 56 -7.457 -2.370 1.972
468 HE ARG 56 HE ARG 56 -8.450 -3.558 0.248
469 1HH1 ARG 56 1HH1 ARG 56 -10.131 -4.161 3.255
470 2HH1 ARG 56 2HH1 ARG 56 -11.520 -4.870 2.490
471 1HH2 ARG 56 1HH2 ARG 56 -10.279 -4.466 -0.781
472 2HH2 ARG 56 2HH2 ARG 56 -11.588 -5.087 0.189
473 H ILE 57 H ILE 57 -3.402 -5.146 0.812
474 HA ILE 57 HA ILE 57 -3.838 -7.108 -1.202
475 HB ILE 57 HB ILE 57 -2.841 -4.839 -1.631
476 1HG1 ILE 57 2HG1 ILE 57 -1.229 -7.199 -2.630
477 2HG1 ILE 57 1HG1 ILE 57 -2.774 -6.674 -3.289
478 1HG2 ILE 57 1HG2 ILE 57 -0.325 -6.100 -0.565
479 2HG2 ILE 57 2HG2 ILE 57 -1.238 -4.804 0.208
480 3HG2 ILE 57 3HG2 ILE 57 -0.454 -4.523 -1.347
481 1HD1 ILE 57 1HD1 ILE 57 -0.915 -5.929 -4.665
482 2HD1 ILE 57 2HD1 ILE 57 -0.232 -5.065 -3.288
483 3HD1 ILE 57 3HD1 ILE 57 -1.778 -4.560 -3.966
484 H ILE 58 H ILE 58 -1.780 -6.978 1.621
485 HA ILE 58 HA ILE 58 -0.118 -9.174 0.983
486 HB ILE 58 HB ILE 58 -1.041 -8.247 3.715
487 1HG1 ILE 58 2HG1 ILE 58 1.531 -7.690 2.216
488 2HG1 ILE 58 1HG1 ILE 58 0.204 -6.548 2.401
489 1HG2 ILE 58 1HG2 ILE 58 -0.244 -10.557 3.753
490 2HG2 ILE 58 2HG2 ILE 58 0.886 -9.481 4.579
491 3HG2 ILE 58 3HG2 ILE 58 1.249 -10.060 2.953
492 1HD1 ILE 58 1HD1 ILE 58 1.853 -7.699 4.641
493 2HD1 ILE 58 2HD1 ILE 58 0.542 -6.529 4.809
494 3HD1 ILE 58 3HD1 ILE 58 2.017 -6.083 3.953
495 H SER 59 H SER 59 -3.211 -8.988 2.760
496 HA SER 59 HA SER 59 -3.467 -11.783 3.102
497 1HB SER 59 2HB SER 59 -5.866 -11.287 3.589
498 2HB SER 59 1HB SER 59 -4.739 -10.304 4.518
499 HG SER 59 HG SER 59 -5.331 -9.046 2.220
500 H GLN 60 H GLN 60 -3.882 -9.790 0.352
501 HA GLN 60 HA GLN 60 -5.655 -11.547 -1.053
502 1HB GLN 60 2HB GLN 60 -5.482 -9.178 -1.681
503 2HB GLN 60 1HB GLN 60 -3.795 -9.412 -2.128
504 1HG GLN 60 2HG GLN 60 -4.509 -11.022 -3.849
505 2HG GLN 60 1HG GLN 60 -6.185 -10.696 -3.428
506 1HE2 GLN 60 1HE2 GLN 60 -6.655 -10.008 -5.478
507 2HE2 GLN 60 2HE2 GLN 60 -6.130 -8.475 -6.096
508 H GLN 61 H GLN 61 -2.173 -11.194 -0.730
509 HA GLN 61 HA GLN 61 -1.577 -13.167 -2.731
510 1HB GLN 61 2HB GLN 61 0.053 -11.411 -2.095
511 2HB GLN 61 1HB GLN 61 0.187 -12.138 -0.499
512 1HG GLN 61 2HG GLN 61 0.936 -14.247 -1.626
513 2HG GLN 61 1HG GLN 61 1.005 -13.335 -3.130
514 1HE2 GLN 61 1HE2 GLN 61 3.119 -14.684 -1.672
515 2HE2 GLN 61 2HE2 GLN 61 4.310 -13.480 -1.324
516 H LYS 62 H LYS 62 -1.748 -13.126 0.805
517 HA LYS 62 HA LYS 62 -1.122 -15.957 0.946
518 1HB LYS 62 2HB LYS 62 -0.246 -14.320 2.626
519 2HB LYS 62 1HB LYS 62 -1.896 -14.061 3.174
520 1HG LYS 62 2HG LYS 62 -0.815 -15.594 4.661
521 2HG LYS 62 1HG LYS 62 -2.045 -16.464 3.742
522 1HD LYS 62 2HD LYS 62 -0.202 -17.159 2.163
523 2HD LYS 62 1HD LYS 62 0.939 -16.498 3.336
524 1HE LYS 62 2HE LYS 62 -1.031 -18.737 3.783
525 2HE LYS 62 1HE LYS 62 0.722 -18.879 3.667
526 1HZ LYS 62 1HZ LYS 62 -0.772 -17.443 5.800
527 2HZ LYS 62 2HZ LYS 62 0.918 -17.540 5.686
528 3HZ LYS 62 3HZ LYS 62 0.004 -18.941 5.960
Start of MODEL 3
1 1H MET 1 1HT MET 1 -15.722 -3.637 -18.196
2 2H MET 1 2HT MET 1 -16.759 -4.559 -17.225
3 3H MET 1 3HT MET 1 -15.093 -4.886 -17.233
4 HA MET 1 HA MET 1 -16.433 -2.462 -16.184
5 1HB MET 1 2HB MET 1 -14.800 -4.615 -14.819
6 2HB MET 1 1HB MET 1 -15.424 -3.172 -14.037
7 1HG MET 1 2HG MET 1 -17.705 -3.918 -14.493
8 2HG MET 1 1HG MET 1 -17.068 -5.374 -15.257
9 1HE MET 1 1HE MET 1 -14.570 -5.997 -13.343
10 2HE MET 1 2HE MET 1 -15.674 -7.246 -13.924
11 3HE MET 1 3HE MET 1 -15.300 -7.129 -12.204
12 H GLY 2 H GLY 2 -14.943 -0.963 -15.123
13 1HA GLY 2 2HA GLY 2 -12.130 -1.181 -15.784
14 2HA GLY 2 1HA GLY 2 -12.993 0.109 -16.610
15 H ASN 3 H ASN 3 -12.085 -1.154 -13.464
16 HA ASN 3 HA ASN 3 -12.956 1.100 -11.973
17 1HB ASN 3 2HB ASN 3 -11.278 0.102 -10.250
18 2HB ASN 3 1HB ASN 3 -12.719 -0.816 -10.673
19 1HD2 ASN 3 1HD2 ASN 3 -9.266 -0.662 -10.845
20 2HD2 ASN 3 2HD2 ASN 3 -9.030 -2.243 -11.512
21 H ILE 4 H ILE 4 -12.207 3.028 -12.572
22 HA ILE 4 HA ILE 4 -9.378 3.289 -13.219
23 HB ILE 4 HB ILE 4 -10.731 4.153 -14.937
24 1HG1 ILE 4 2HG1 ILE 4 -9.779 6.514 -13.304
25 2HG1 ILE 4 1HG1 ILE 4 -8.774 5.536 -14.372
26 1HG2 ILE 4 1HG2 ILE 4 -12.484 5.794 -14.663
27 2HG2 ILE 4 2HG2 ILE 4 -12.199 5.849 -12.925
28 3HG2 ILE 4 3HG2 ILE 4 -12.817 4.375 -13.671
29 1HD1 ILE 4 1HD1 ILE 4 -11.110 7.245 -15.199
30 2HD1 ILE 4 2HD1 ILE 4 -10.133 6.249 -16.278
31 3HD1 ILE 4 3HD1 ILE 4 -9.402 7.616 -15.437
32 H ARG 5 H ARG 5 -11.773 5.206 -11.320
33 HA ARG 5 HA ARG 5 -9.550 6.668 -10.160
34 1HB ARG 5 2HB ARG 5 -11.720 7.733 -11.002
35 2HB ARG 5 1HB ARG 5 -12.458 7.111 -9.530
36 1HG ARG 5 2HG ARG 5 -10.919 8.402 -8.177
37 2HG ARG 5 1HG ARG 5 -10.087 8.967 -9.627
38 1HD ARG 5 2HD ARG 5 -11.511 10.728 -9.028
39 2HD ARG 5 1HD ARG 5 -12.336 9.911 -10.351
40 HE ARG 5 HE ARG 5 -13.080 9.116 -7.648
41 1HH1 ARG 5 1HH1 ARG 5 -13.843 10.921 -10.553
42 2HH1 ARG 5 2HH1 ARG 5 -15.483 11.262 -10.071
43 1HH2 ARG 5 1HH2 ARG 5 -15.231 9.590 -6.988
44 2HH2 ARG 5 2HH2 ARG 5 -16.251 10.544 -8.023
45 H THR 6 H THR 6 -8.982 4.475 -9.181
46 HA THR 6 HA THR 6 -9.335 4.725 -6.383
47 HB THR 6 HB THR 6 -11.455 3.646 -6.660
48 HG1 THR 6 1HG THR 6 -10.058 2.848 -4.943
49 1HG2 THR 6 1HG2 THR 6 -11.708 1.446 -7.741
50 2HG2 THR 6 2HG2 THR 6 -10.016 1.509 -8.237
51 3HG2 THR 6 3HG2 THR 6 -11.166 2.682 -8.878
52 H SER 7 H SER 7 -8.389 2.689 -9.095
53 HA SER 7 HA SER 7 -6.577 1.086 -7.609
54 1HB SER 7 2HB SER 7 -6.745 1.518 -10.595
55 2HB SER 7 1HB SER 7 -5.931 0.184 -9.776
56 HG SER 7 HG SER 7 -7.846 -0.662 -9.194
57 H PHE 8 H PHE 8 -6.332 4.277 -8.529
58 HA PHE 8 HA PHE 8 -3.662 4.482 -9.377
59 1HB PHE 8 2HB PHE 8 -5.362 6.453 -7.839
60 2HB PHE 8 1HB PHE 8 -3.790 6.832 -8.527
61 HD1 PHE 8 1HD PHE 8 -3.597 6.184 -11.117
62 HD2 PHE 8 2HD PHE 8 -7.210 7.060 -9.039
63 HE1 PHE 8 1HE PHE 8 -4.666 6.800 -13.245
64 HE2 PHE 8 2HE PHE 8 -8.286 7.676 -11.167
65 HZ PHE 8 HZ PHE 8 -7.013 7.545 -13.271
66 H VAL 9 H VAL 9 -5.027 5.014 -6.132
67 HA VAL 9 HA VAL 9 -2.542 5.170 -4.798
68 HB VAL 9 HB VAL 9 -5.219 4.370 -3.635
69 1HG1 VAL 9 1HG1 VAL 9 -2.782 5.553 -2.314
70 2HG1 VAL 9 2HG1 VAL 9 -3.331 3.884 -2.160
71 3HG1 VAL 9 3HG1 VAL 9 -4.320 5.201 -1.526
72 1HG2 VAL 9 1HG2 VAL 9 -5.382 6.496 -4.824
73 2HG2 VAL 9 2HG2 VAL 9 -3.989 7.109 -3.935
74 3HG2 VAL 9 3HG2 VAL 9 -5.488 6.747 -3.081
75 H LYS 10 H LYS 10 -4.738 2.529 -5.509
76 HA LYS 10 HA LYS 10 -3.570 0.543 -3.916
77 1HB LYS 10 2HB LYS 10 -5.798 0.428 -5.069
78 2HB LYS 10 1HB LYS 10 -4.945 0.163 -6.582
79 1HG LYS 10 2HG LYS 10 -3.962 -1.893 -5.626
80 2HG LYS 10 1HG LYS 10 -4.927 -1.640 -4.168
81 1HD LYS 10 2HD LYS 10 -6.970 -1.691 -5.570
82 2HD LYS 10 1HD LYS 10 -5.964 -2.082 -6.966
83 1HE LYS 10 2HE LYS 10 -5.183 -4.108 -5.776
84 2HE LYS 10 1HE LYS 10 -6.295 -3.726 -4.461
85 1HZ LYS 10 1HZ LYS 10 -8.111 -3.805 -6.136
86 2HZ LYS 10 2HZ LYS 10 -7.354 -5.295 -5.862
87 3HZ LYS 10 3HZ LYS 10 -6.992 -4.407 -7.264
88 H ARG 11 H ARG 11 -2.933 1.550 -7.251
89 HA ARG 11 HA ARG 11 -0.982 -0.431 -7.793
90 1HB ARG 11 2HB ARG 11 -2.189 0.733 -9.569
91 2HB ARG 11 1HB ARG 11 -1.467 2.261 -9.087
92 1HG ARG 11 2HG ARG 11 0.381 0.061 -9.804
93 2HG ARG 11 1HG ARG 11 -0.552 0.798 -11.108
94 1HD ARG 11 2HD ARG 11 1.192 2.292 -9.147
95 2HD ARG 11 1HD ARG 11 1.647 1.864 -10.797
96 HE ARG 11 HE ARG 11 -0.701 3.251 -11.054
97 1HH1 ARG 11 1HH1 ARG 11 2.421 3.928 -9.587
98 2HH1 ARG 11 2HH1 ARG 11 2.341 5.630 -9.941
99 1HH2 ARG 11 1HH2 ARG 11 -0.807 5.462 -11.501
100 2HH2 ARG 11 2HH2 ARG 11 0.510 6.507 -11.055
101 H ILE 12 H ILE 12 -0.789 2.903 -6.609
102 HA ILE 12 HA ILE 12 1.999 3.174 -6.583
103 HB ILE 12 HB ILE 12 -0.037 4.358 -4.681
104 1HG1 ILE 12 2HG1 ILE 12 1.299 5.537 -7.127
105 2HG1 ILE 12 1HG1 ILE 12 -0.350 4.923 -7.074
106 1HG2 ILE 12 1HG2 ILE 12 2.179 4.422 -3.687
107 2HG2 ILE 12 2HG2 ILE 12 1.673 6.042 -4.169
108 3HG2 ILE 12 3HG2 ILE 12 2.835 5.154 -5.153
109 1HD1 ILE 12 1HD1 ILE 12 -0.263 7.359 -6.928
110 2HD1 ILE 12 2HD1 ILE 12 0.703 7.235 -5.458
111 3HD1 ILE 12 3HD1 ILE 12 -0.956 6.640 -5.475
112 H ALA 13 H ALA 13 -0.218 1.945 -4.100
113 HA ALA 13 HA ALA 13 1.734 1.282 -2.190
114 1HB ALA 13 1HB ALA 13 -0.657 1.399 -1.667
115 2HB ALA 13 2HB ALA 13 0.035 -0.152 -1.194
116 3HB ALA 13 3HB ALA 13 -0.943 -0.031 -2.658
117 H LYS 14 H LYS 14 0.296 -0.566 -4.835
118 HA LYS 14 HA LYS 14 1.436 -3.055 -4.340
119 1HB LYS 14 2HB LYS 14 -0.362 -2.407 -6.028
120 2HB LYS 14 1HB LYS 14 0.942 -1.888 -7.081
121 1HG LYS 14 2HG LYS 14 0.901 -4.674 -6.001
122 2HG LYS 14 1HG LYS 14 -0.097 -4.234 -7.384
123 1HD LYS 14 2HD LYS 14 1.987 -3.380 -8.494
124 2HD LYS 14 1HD LYS 14 2.903 -4.087 -7.161
125 1HE LYS 14 2HE LYS 14 2.044 -6.287 -7.695
126 2HE LYS 14 1HE LYS 14 1.030 -5.611 -8.968
127 1HZ LYS 14 1HZ LYS 14 4.001 -5.724 -8.911
128 2HZ LYS 14 2HZ LYS 14 3.110 -4.880 -10.080
129 3HZ LYS 14 3HZ LYS 14 2.959 -6.562 -9.951
130 H GLU 15 H GLU 15 2.700 -0.309 -6.214
131 HA GLU 15 HA GLU 15 5.081 -1.517 -7.088
132 1HB GLU 15 2HB GLU 15 4.539 1.390 -6.460
133 2HB GLU 15 1HB GLU 15 5.929 0.796 -7.357
134 1HG GLU 15 2HG GLU 15 4.445 -0.066 -9.089
135 2HG GLU 15 1HG GLU 15 3.051 0.527 -8.188
136 H MET 16 H MET 16 4.298 0.230 -4.138
137 HA MET 16 HA MET 16 6.954 0.300 -3.131
138 1HB MET 16 2HB MET 16 5.323 1.920 -2.395
139 2HB MET 16 1HB MET 16 4.278 0.651 -1.778
140 1HG MET 16 2HG MET 16 5.648 0.231 0.045
141 2HG MET 16 1HG MET 16 7.042 1.010 -0.698
142 1HE MET 16 1HE MET 16 3.373 3.372 0.812
143 2HE MET 16 2HE MET 16 3.465 1.612 0.828
144 3HE MET 16 3HE MET 16 3.400 2.477 -0.707
145 H ILE 17 H ILE 17 4.157 -1.784 -2.413
146 HA ILE 17 HA ILE 17 5.299 -3.312 -0.365
147 HB ILE 17 HB ILE 17 3.268 -4.215 -2.415
148 1HG1 ILE 17 2HG1 ILE 17 2.789 -3.057 0.337
149 2HG1 ILE 17 1HG1 ILE 17 2.660 -2.136 -1.160
150 1HG2 ILE 17 1HG2 ILE 17 2.559 -5.809 -0.677
151 2HG2 ILE 17 2HG2 ILE 17 3.920 -5.296 0.321
152 3HG2 ILE 17 3HG2 ILE 17 4.211 -6.093 -1.224
153 1HD1 ILE 17 1HD1 ILE 17 0.477 -2.829 -0.418
154 2HD1 ILE 17 2HD1 ILE 17 0.994 -4.515 -0.379
155 3HD1 ILE 17 3HD1 ILE 17 0.890 -3.659 -1.918
156 H GLU 18 H GLU 18 5.320 -3.785 -3.856
157 HA GLU 18 HA GLU 18 6.301 -6.426 -3.832
158 1HB GLU 18 2HB GLU 18 5.032 -5.211 -5.655
159 2HB GLU 18 1HB GLU 18 6.550 -4.443 -6.083
160 1HG GLU 18 2HG GLU 18 7.511 -6.479 -6.756
161 2HG GLU 18 1HG GLU 18 6.228 -7.423 -5.997
162 H THR 19 H THR 19 7.911 -3.627 -3.019
163 HA THR 19 HA THR 19 10.494 -4.290 -4.088
164 HB THR 19 HB THR 19 10.016 -2.476 -1.725
165 HG1 THR 19 1HG THR 19 8.640 -1.568 -3.124
166 1HG2 THR 19 1HG2 THR 19 12.014 -2.429 -4.000
167 2HG2 THR 19 2HG2 THR 19 12.348 -2.933 -2.343
168 3HG2 THR 19 3HG2 THR 19 11.923 -1.255 -2.685
169 H HIS 20 H HIS 20 8.614 -5.237 -1.362
170 HA HIS 20 HA HIS 20 10.810 -6.960 -0.486
171 1HB HIS 20 2HB HIS 20 9.370 -4.979 1.234
172 2HB HIS 20 1HB HIS 20 9.839 -6.520 1.934
173 HD1 HIS 20 1HD HIS 20 12.158 -6.697 2.789
174 HD2 HIS 20 2HD HIS 20 11.649 -3.438 0.258
175 HE1 HIS 20 1HE HIS 20 14.286 -5.371 2.957
176 HE2 HIS 20 2HE HIS 20 13.832 -3.276 1.633
177 HA PRO 21 HA PRO 21 6.886 -9.330 -0.860
178 1HB PRO 21 2HB PRO 21 7.993 -11.498 -2.036
179 2HB PRO 21 1HB PRO 21 7.504 -10.069 -2.955
180 1HG PRO 21 2HG PRO 21 10.227 -10.876 -2.012
181 2HG PRO 21 1HG PRO 21 9.742 -10.194 -3.575
182 1HD PRO 21 2HD PRO 21 10.868 -8.711 -1.586
183 2HD PRO 21 1HD PRO 21 9.731 -8.041 -2.771
184 H GLY 22 H GLY 22 9.953 -9.807 0.608
185 1HA GLY 22 2HA GLY 22 9.308 -12.342 1.850
186 2HA GLY 22 1HA GLY 22 10.768 -11.395 2.091
187 H LYS 23 H LYS 23 7.286 -11.032 2.694
188 HA LYS 23 HA LYS 23 7.806 -10.763 5.550
189 1HB LYS 23 2HB LYS 23 6.288 -8.692 3.942
190 2HB LYS 23 1HB LYS 23 6.230 -8.810 5.692
191 1HG LYS 23 2HG LYS 23 8.786 -8.376 4.166
192 2HG LYS 23 1HG LYS 23 7.773 -7.059 4.756
193 1HD LYS 23 2HD LYS 23 8.854 -9.226 6.552
194 2HD LYS 23 1HD LYS 23 9.726 -7.725 6.230
195 1HE LYS 23 2HE LYS 23 7.881 -6.432 7.144
196 2HE LYS 23 1HE LYS 23 6.943 -7.903 7.397
197 1HZ LYS 23 1HZ LYS 23 8.005 -7.112 9.441
198 2HZ LYS 23 2HZ LYS 23 9.533 -7.278 8.716
199 3HZ LYS 23 3HZ LYS 23 8.575 -8.650 8.993
200 H PHE 24 H PHE 24 5.038 -10.101 3.465
201 HA PHE 24 HA PHE 24 2.929 -10.912 3.361
202 1HB PHE 24 2HB PHE 24 2.833 -13.300 2.701
203 2HB PHE 24 1HB PHE 24 4.036 -12.365 1.828
204 HD1 PHE 24 1HD PHE 24 3.545 -14.928 4.442
205 HD2 PHE 24 2HD PHE 24 6.340 -12.932 1.925
206 HE1 PHE 24 1HE PHE 24 5.251 -16.612 5.001
207 HE2 PHE 24 2HE PHE 24 8.049 -14.610 2.485
208 HZ PHE 24 HZ PHE 24 7.505 -16.456 4.026
209 H THR 25 H THR 25 3.775 -10.669 6.176
210 HA THR 25 HA THR 25 2.574 -12.953 7.482
211 HB THR 25 HB THR 25 3.377 -10.359 8.798
212 HG1 THR 25 1HG THR 25 4.936 -12.465 7.769
213 1HG2 THR 25 1HG2 THR 25 3.746 -11.797 10.745
214 2HG2 THR 25 2HG2 THR 25 3.255 -13.206 9.806
215 3HG2 THR 25 3HG2 THR 25 2.085 -11.937 10.167
216 H ASP 26 H ASP 26 1.559 -9.913 6.273
217 HA ASP 26 HA ASP 26 -0.322 -8.660 6.432
218 1HB ASP 26 2HB ASP 26 -1.475 -10.689 5.729
219 2HB ASP 26 1HB ASP 26 -1.520 -11.272 7.390
220 H ASP 27 H ASP 27 1.247 -7.936 8.221
221 HA ASP 27 HA ASP 27 -0.345 -7.633 10.670
222 1HB ASP 27 2HB ASP 27 1.532 -9.273 11.018
223 2HB ASP 27 1HB ASP 27 2.667 -7.996 10.599
224 H PHE 28 H PHE 28 0.527 -5.661 11.934
225 HA PHE 28 HA PHE 28 0.640 -3.491 10.052
226 1HB PHE 28 2HB PHE 28 0.592 -3.562 13.073
227 2HB PHE 28 1HB PHE 28 0.663 -2.066 12.142
228 HD1 PHE 28 1HD PHE 28 -1.441 -4.746 13.332
229 HD2 PHE 28 2HD PHE 28 -1.198 -1.498 10.592
230 HE1 PHE 28 1HE PHE 28 -3.885 -4.802 13.050
231 HE2 PHE 28 2HE PHE 28 -3.640 -1.546 10.311
232 HZ PHE 28 HZ PHE 28 -4.987 -3.198 11.537
233 H ASP 29 H ASP 29 2.939 -5.289 11.933
234 HA ASP 29 HA ASP 29 5.134 -3.516 11.623
235 1HB ASP 29 2HB ASP 29 5.407 -5.420 13.072
236 2HB ASP 29 1HB ASP 29 5.014 -6.538 11.769
237 H THR 30 H THR 30 3.590 -5.880 9.577
238 HA THR 30 HA THR 30 5.470 -6.004 7.512
239 HB THR 30 HB THR 30 2.489 -6.245 7.113
240 HG1 THR 30 1HG THR 30 4.314 -8.077 8.316
241 1HG2 THR 30 1HG2 THR 30 4.843 -7.629 5.833
242 2HG2 THR 30 2HG2 THR 30 3.856 -6.363 5.105
243 3HG2 THR 30 3HG2 THR 30 3.145 -7.936 5.466
244 H ASN 31 H ASN 31 2.407 -4.145 7.609
245 HA ASN 31 HA ASN 31 2.962 -2.876 5.148
246 1HB ASN 31 2HB ASN 31 1.033 -1.365 5.728
247 2HB ASN 31 1HB ASN 31 0.677 -3.082 5.705
248 1HD2 ASN 31 1HD2 ASN 31 -1.166 -2.742 6.956
249 2HD2 ASN 31 2HD2 ASN 31 -1.067 -2.410 8.651
250 H LYS 32 H LYS 32 3.213 -1.662 8.483
251 HA LYS 32 HA LYS 32 3.837 0.980 7.916
252 1HB LYS 32 2HB LYS 32 3.339 -0.085 10.159
253 2HB LYS 32 1HB LYS 32 5.010 -0.622 10.187
254 1HG LYS 32 2HG LYS 32 5.756 1.710 10.122
255 2HG LYS 32 1HG LYS 32 4.072 2.241 10.115
256 1HD LYS 32 2HD LYS 32 3.786 0.942 12.263
257 2HD LYS 32 1HD LYS 32 5.541 0.768 12.290
258 1HE LYS 32 2HE LYS 32 4.075 3.401 12.208
259 2HE LYS 32 1HE LYS 32 4.685 2.643 13.677
260 1HZ LYS 32 1HZ LYS 32 6.335 3.525 11.366
261 2HZ LYS 32 2HZ LYS 32 6.924 2.785 12.779
262 3HZ LYS 32 3HZ LYS 32 6.203 4.317 12.861
263 H LYS 33 H LYS 33 6.006 -1.800 8.260
264 HA LYS 33 HA LYS 33 8.383 -0.259 7.995
265 1HB LYS 33 2HB LYS 33 8.161 -2.485 9.151
266 2HB LYS 33 1HB LYS 33 8.068 -3.227 7.561
267 1HG LYS 33 2HG LYS 33 10.277 -2.578 7.028
268 2HG LYS 33 1HG LYS 33 10.377 -1.523 8.440
269 1HD LYS 33 2HD LYS 33 10.133 -4.528 8.482
270 2HD LYS 33 1HD LYS 33 11.600 -3.603 8.802
271 1HE LYS 33 2HE LYS 33 10.399 -2.511 10.704
272 2HE LYS 33 1HE LYS 33 9.061 -3.626 10.429
273 1HZ LYS 33 1HZ LYS 33 10.472 -4.456 12.170
274 2HZ LYS 33 2HZ LYS 33 11.842 -4.352 11.176
275 3HZ LYS 33 3HZ LYS 33 10.620 -5.469 10.818
276 H LEU 34 H LEU 34 6.238 -1.850 5.749
277 HA LEU 34 HA LEU 34 8.060 -1.724 3.534
278 1HB LEU 34 2HB LEU 34 5.070 -2.135 3.602
279 2HB LEU 34 1HB LEU 34 6.055 -2.256 2.157
280 HG LEU 34 HG LEU 34 6.162 -4.052 4.578
281 1HD1 LEU 34 1HD1 LEU 34 5.491 -5.778 2.986
282 2HD1 LEU 34 2HD1 LEU 34 5.395 -4.565 1.708
283 3HD1 LEU 34 3HD1 LEU 34 4.297 -4.485 3.085
284 1HD2 LEU 34 1HD2 LEU 34 8.413 -3.672 3.734
285 2HD2 LEU 34 2HD2 LEU 34 7.885 -4.084 2.105
286 3HD2 LEU 34 3HD2 LEU 34 7.872 -5.310 3.371
287 H VAL 35 H VAL 35 5.567 0.357 4.865
288 HA VAL 35 HA VAL 35 5.393 2.140 2.669
289 HB VAL 35 HB VAL 35 4.966 2.838 5.581
290 1HG1 VAL 35 1HG1 VAL 35 3.880 4.054 3.053
291 2HG1 VAL 35 2HG1 VAL 35 5.105 4.761 4.108
292 3HG1 VAL 35 3HG1 VAL 35 3.459 4.531 4.698
293 1HG2 VAL 35 1HG2 VAL 35 2.607 2.324 5.208
294 2HG2 VAL 35 2HG2 VAL 35 3.621 0.897 4.994
295 3HG2 VAL 35 3HG2 VAL 35 2.990 1.748 3.586
296 H GLU 36 H GLU 36 7.531 1.902 5.437
297 HA GLU 36 HA GLU 36 8.879 4.376 5.044
298 1HB GLU 36 2HB GLU 36 9.604 1.852 6.525
299 2HB GLU 36 1HB GLU 36 10.691 3.231 6.447
300 1HG GLU 36 2HG GLU 36 7.903 3.255 7.577
301 2HG GLU 36 1HG GLU 36 9.399 3.201 8.510
302 H GLU 37 H GLU 37 8.872 1.562 3.220
303 HA GLU 37 HA GLU 37 11.691 1.493 2.651
304 1HB GLU 37 2HB GLU 37 10.200 -0.539 2.707
305 2HB GLU 37 1HB GLU 37 9.497 0.023 1.194
306 1HG GLU 37 2HG GLU 37 11.212 -1.671 0.829
307 2HG GLU 37 1HG GLU 37 11.653 -0.121 0.106
308 H PHE 38 H PHE 38 8.794 2.112 0.610
309 HA PHE 38 HA PHE 38 10.656 3.118 -1.410
310 1HB PHE 38 2HB PHE 38 8.566 1.366 -1.649
311 2HB PHE 38 1HB PHE 38 7.853 2.876 -2.212
312 HD1 PHE 38 1HD PHE 38 10.942 0.840 -2.626
313 HD2 PHE 38 2HD PHE 38 8.111 3.447 -4.439
314 HE1 PHE 38 1HE PHE 38 12.054 0.530 -4.797
315 HE2 PHE 38 2HE PHE 38 9.217 3.142 -6.614
316 HZ PHE 38 HZ PHE 38 11.191 1.681 -6.796
317 H SER 39 H SER 39 8.515 4.532 -2.835
318 HA SER 39 HA SER 39 9.159 7.059 -1.557
319 1HB SER 39 2HB SER 39 9.772 6.747 -3.893
320 2HB SER 39 1HB SER 39 8.095 6.409 -4.314
321 HG SER 39 HG SER 39 8.138 8.482 -4.741
322 H THR 40 H THR 40 7.780 8.193 -0.443
323 HA THR 40 HA THR 40 5.053 8.513 -1.417
324 HB THR 40 HB THR 40 4.243 8.621 1.019
325 HG1 THR 40 1HG THR 40 6.693 7.209 1.346
326 1HG2 THR 40 1HG2 THR 40 3.761 6.225 1.105
327 2HG2 THR 40 2HG2 THR 40 4.975 5.937 -0.142
328 3HG2 THR 40 3HG2 THR 40 3.530 6.877 -0.518
329 H VAL 41 H VAL 41 4.860 10.658 -1.776
330 HA VAL 41 HA VAL 41 6.548 12.436 -0.150
331 HB VAL 41 HB VAL 41 7.409 12.279 -2.403
332 1HG1 VAL 41 1HG1 VAL 41 6.119 13.048 -4.342
333 2HG1 VAL 41 2HG1 VAL 41 4.694 13.215 -3.318
334 3HG1 VAL 41 3HG1 VAL 41 5.399 11.622 -3.593
335 1HG2 VAL 41 1HG2 VAL 41 6.051 14.926 -1.903
336 2HG2 VAL 41 2HG2 VAL 41 7.405 14.661 -3.001
337 3HG2 VAL 41 3HG2 VAL 41 7.615 14.419 -1.267
338 H SER 42 H SER 42 5.591 13.929 0.985
339 HA SER 42 HA SER 42 4.108 15.433 1.794
340 1HB SER 42 2HB SER 42 3.108 15.487 -1.062
341 2HB SER 42 1HB SER 42 2.733 16.685 0.178
342 HG SER 42 HG SER 42 4.702 16.836 -1.444
343 H THR 43 H THR 43 3.398 12.482 1.419
344 HA THR 43 HA THR 43 0.486 12.731 1.822
345 HB THR 43 HB THR 43 0.504 10.239 1.237
346 HG1 THR 43 1HG THR 43 3.071 10.549 1.308
347 1HG2 THR 43 1HG2 THR 43 1.305 12.208 -0.908
348 2HG2 THR 43 2HG2 THR 43 -0.333 11.952 -0.304
349 3HG2 THR 43 3HG2 THR 43 0.500 10.663 -1.173
350 H LYS 44 H LYS 44 2.258 13.246 3.905
351 HA LYS 44 HA LYS 44 3.319 11.110 5.275
352 1HB LYS 44 2HB LYS 44 3.503 12.571 7.210
353 2HB LYS 44 1HB LYS 44 3.969 13.397 5.734
354 1HG LYS 44 2HG LYS 44 1.234 13.688 6.945
355 2HG LYS 44 1HG LYS 44 2.596 14.704 7.414
356 1HD LYS 44 2HD LYS 44 2.833 15.242 4.927
357 2HD LYS 44 1HD LYS 44 1.236 14.513 4.739
358 1HE LYS 44 2HE LYS 44 1.006 16.904 4.977
359 2HE LYS 44 1HE LYS 44 0.347 16.105 6.405
360 1HZ LYS 44 1HZ LYS 44 2.447 16.572 7.554
361 2HZ LYS 44 2HZ LYS 44 1.677 17.994 7.053
362 3HZ LYS 44 3HZ LYS 44 3.011 17.404 6.192
363 H HIS 45 H HIS 45 -0.014 12.312 5.509
364 HA HIS 45 HA HIS 45 -0.427 10.169 7.484
365 1HB HIS 45 2HB HIS 45 -1.508 12.923 7.408
366 2HB HIS 45 1HB HIS 45 -2.586 11.652 7.983
367 HD1 HIS 45 1HD HIS 45 -0.038 13.911 9.164
368 HD2 HIS 45 2HD HIS 45 -1.276 10.058 10.143
369 HE1 HIS 45 1HE HIS 45 0.915 13.445 11.442
370 HE2 HIS 45 2HE HIS 45 -0.001 11.192 12.088
371 H LEU 46 H LEU 46 -1.412 11.374 4.398
372 HA LEU 46 HA LEU 46 -3.656 9.645 4.096
373 1HB LEU 46 2HB LEU 46 -3.069 11.470 2.501
374 2HB LEU 46 1HB LEU 46 -1.665 10.548 2.000
375 HG LEU 46 HG LEU 46 -3.162 8.759 1.170
376 1HD1 LEU 46 1HD1 LEU 46 -5.365 10.707 1.830
377 2HD1 LEU 46 2HD1 LEU 46 -5.054 9.185 2.664
378 3HD1 LEU 46 3HD1 LEU 46 -5.549 9.178 0.970
379 1HD2 LEU 46 1HD2 LEU 46 -3.731 11.504 0.058
380 2HD2 LEU 46 2HD2 LEU 46 -3.971 9.976 -0.788
381 3HD2 LEU 46 3HD2 LEU 46 -2.343 10.494 -0.344
382 H ARG 47 H ARG 47 -0.289 9.328 4.195
383 HA ARG 47 HA ARG 47 0.393 6.906 3.122
384 1HB ARG 47 2HB ARG 47 1.526 8.801 4.754
385 2HB ARG 47 1HB ARG 47 1.439 7.414 5.823
386 1HG ARG 47 2HG ARG 47 2.726 6.102 4.213
387 2HG ARG 47 1HG ARG 47 2.829 7.518 3.157
388 1HD ARG 47 2HD ARG 47 3.957 8.763 4.921
389 2HD ARG 47 1HD ARG 47 3.826 7.381 6.000
390 HE ARG 47 HE ARG 47 5.346 7.148 3.491
391 1HH1 ARG 47 1HH1 ARG 47 5.200 7.103 6.991
392 2HH1 ARG 47 2HH1 ARG 47 6.821 6.500 7.192
393 1HH2 ARG 47 1HH2 ARG 47 7.501 6.364 3.746
394 2HH2 ARG 47 2HH2 ARG 47 8.120 6.100 5.351
395 H ASN 48 H ASN 48 -1.239 7.579 6.168
396 HA ASN 48 HA ASN 48 -0.999 5.036 7.337
397 1HB ASN 48 2HB ASN 48 -3.150 7.122 7.782
398 2HB ASN 48 1HB ASN 48 -2.811 5.760 8.845
399 1HD2 ASN 48 1HD2 ASN 48 -2.301 6.990 10.622
400 2HD2 ASN 48 2HD2 ASN 48 -0.873 7.968 10.712
401 H LYS 49 H LYS 49 -3.475 6.436 5.248
402 HA LYS 49 HA LYS 49 -5.224 4.206 5.320
403 1HB LYS 49 2HB LYS 49 -4.863 6.433 3.319
404 2HB LYS 49 1HB LYS 49 -6.083 5.182 3.136
405 1HG LYS 49 2HG LYS 49 -7.089 5.853 5.262
406 2HG LYS 49 1HG LYS 49 -5.860 7.105 5.442
407 1HD LYS 49 2HD LYS 49 -6.657 8.252 3.492
408 2HD LYS 49 1HD LYS 49 -7.774 6.938 3.119
409 1HE LYS 49 2HE LYS 49 -8.899 8.869 4.151
410 2HE LYS 49 1HE LYS 49 -9.047 7.403 5.117
411 1HZ LYS 49 1HZ LYS 49 -7.016 9.508 5.629
412 2HZ LYS 49 2HZ LYS 49 -7.404 8.190 6.624
413 3HZ LYS 49 3HZ LYS 49 -8.523 9.446 6.403
414 H ILE 50 H ILE 50 -2.531 5.133 3.235
415 HA ILE 50 HA ILE 50 -2.723 3.072 1.349
416 HB ILE 50 HB ILE 50 -0.208 4.411 2.362
417 1HG1 ILE 50 2HG1 ILE 50 -1.982 5.122 0.013
418 2HG1 ILE 50 1HG1 ILE 50 -1.912 6.007 1.536
419 1HG2 ILE 50 1HG2 ILE 50 -0.751 2.907 -0.195
420 2HG2 ILE 50 2HG2 ILE 50 0.285 2.384 1.135
421 3HG2 ILE 50 3HG2 ILE 50 0.728 3.795 0.176
422 1HD1 ILE 50 1HD1 ILE 50 0.412 6.581 1.101
423 2HD1 ILE 50 2HD1 ILE 50 -0.633 7.114 -0.216
424 3HD1 ILE 50 3HD1 ILE 50 0.363 5.672 -0.409
425 H ALA 51 H ALA 51 -1.104 3.221 4.488
426 HA ALA 51 HA ALA 51 0.177 0.738 4.425
427 1HB ALA 51 1HB ALA 51 -0.975 2.137 6.838
428 2HB ALA 51 2HB ALA 51 0.603 2.468 6.125
429 3HB ALA 51 3HB ALA 51 0.276 0.892 6.845
430 H GLY 52 H GLY 52 -3.102 1.624 5.411
431 1HA GLY 52 2HA GLY 52 -3.962 -0.901 6.279
432 2HA GLY 52 1HA GLY 52 -5.005 0.350 5.613
433 H TYR 53 H TYR 53 -4.140 0.573 3.044
434 HA TYR 53 HA TYR 53 -5.301 -1.548 1.671
435 1HB TYR 53 2HB TYR 53 -3.353 0.582 0.809
436 2HB TYR 53 1HB TYR 53 -3.908 -0.648 -0.317
437 HD1 TYR 53 1HD TYR 53 -4.908 2.276 1.677
438 HD2 TYR 53 2HD TYR 53 -6.146 -0.602 -1.203
439 HE1 TYR 53 1HE TYR 53 -6.880 3.647 1.162
440 HE2 TYR 53 2HE TYR 53 -8.125 0.761 -1.723
441 HH TYR 53 HH TYR 53 -8.471 3.986 -0.604
442 H ILE 54 H ILE 54 -1.901 -0.941 2.443
443 HA ILE 54 HA ILE 54 -0.714 -2.943 0.950
444 HB ILE 54 HB ILE 54 0.103 -1.846 3.637
445 1HG1 ILE 54 2HG1 ILE 54 0.968 -1.240 0.804
446 2HG1 ILE 54 1HG1 ILE 54 0.020 -0.193 1.853
447 1HG2 ILE 54 1HG2 ILE 54 1.155 -4.004 3.360
448 2HG2 ILE 54 2HG2 ILE 54 2.352 -2.731 3.124
449 3HG2 ILE 54 3HG2 ILE 54 1.677 -3.576 1.731
450 1HD1 ILE 54 1HD1 ILE 54 2.327 0.535 1.718
451 2HD1 ILE 54 2HD1 ILE 54 2.869 -1.036 2.310
452 3HD1 ILE 54 3HD1 ILE 54 1.923 0.024 3.355
453 H THR 55 H THR 55 -1.691 -3.197 4.394
454 HA THR 55 HA THR 55 -1.133 -5.852 4.815
455 HB THR 55 HB THR 55 -3.632 -5.337 6.073
456 HG1 THR 55 1HG THR 55 -3.481 -3.161 5.650
457 1HG2 THR 55 1HG2 THR 55 -0.805 -5.072 7.104
458 2HG2 THR 55 2HG2 THR 55 -1.738 -6.566 7.038
459 3HG2 THR 55 3HG2 THR 55 -2.255 -5.251 8.094
460 H ARG 56 H ARG 56 -4.131 -4.491 3.458
461 HA ARG 56 HA ARG 56 -5.434 -7.003 3.232
462 1HB ARG 56 2HB ARG 56 -6.008 -4.419 1.776
463 2HB ARG 56 1HB ARG 56 -7.081 -5.812 1.854
464 1HG ARG 56 2HG ARG 56 -7.112 -5.548 4.337
465 2HG ARG 56 1HG ARG 56 -6.227 -4.035 4.125
466 1HD ARG 56 2HD ARG 56 -8.069 -3.233 2.666
467 2HD ARG 56 1HD ARG 56 -8.958 -4.708 3.038
468 HE ARG 56 HE ARG 56 -8.259 -2.603 4.989
469 1HH1 ARG 56 1HH1 ARG 56 -10.181 -5.382 4.052
470 2HH1 ARG 56 2HH1 ARG 56 -11.394 -5.114 5.276
471 1HH2 ARG 56 1HH2 ARG 56 -9.850 -2.242 6.589
472 2HH2 ARG 56 2HH2 ARG 56 -11.185 -3.346 6.731
473 H ILE 57 H ILE 57 -3.604 -5.036 0.908
474 HA ILE 57 HA ILE 57 -4.034 -6.659 -1.347
475 HB ILE 57 HB ILE 57 -1.660 -4.913 -0.667
476 1HG1 ILE 57 2HG1 ILE 57 -4.032 -4.419 -2.480
477 2HG1 ILE 57 1HG1 ILE 57 -3.840 -3.750 -0.864
478 1HG2 ILE 57 1HG2 ILE 57 -0.999 -6.576 -2.310
479 2HG2 ILE 57 2HG2 ILE 57 -1.120 -4.987 -3.064
480 3HG2 ILE 57 3HG2 ILE 57 -2.400 -6.177 -3.304
481 1HD1 ILE 57 1HD1 ILE 57 -1.844 -2.542 -1.619
482 2HD1 ILE 57 2HD1 ILE 57 -3.280 -2.108 -2.544
483 3HD1 ILE 57 3HD1 ILE 57 -2.079 -3.194 -3.241
484 H ILE 58 H ILE 58 -1.527 -6.755 1.164
485 HA ILE 58 HA ILE 58 -0.006 -8.835 0.042
486 HB ILE 58 HB ILE 58 -0.318 -8.007 2.925
487 1HG1 ILE 58 2HG1 ILE 58 1.839 -7.448 0.876
488 2HG1 ILE 58 1HG1 ILE 58 0.618 -6.300 1.415
489 1HG2 ILE 58 1HG2 ILE 58 1.698 -9.881 1.692
490 2HG2 ILE 58 2HG2 ILE 58 0.447 -10.302 2.862
491 3HG2 ILE 58 3HG2 ILE 58 1.776 -9.242 3.333
492 1HD1 ILE 58 1HD1 ILE 58 2.794 -7.513 3.094
493 2HD1 ILE 58 2HD1 ILE 58 1.544 -6.419 3.684
494 3HD1 ILE 58 3HD1 ILE 58 2.721 -5.856 2.498
495 H SER 59 H SER 59 -2.736 -8.926 2.328
496 HA SER 59 HA SER 59 -2.644 -11.717 2.732
497 1HB SER 59 2HB SER 59 -5.029 -11.448 3.508
498 2HB SER 59 1HB SER 59 -3.863 -10.398 4.308
499 HG SER 59 HG SER 59 -4.843 -9.170 2.120
500 H GLN 60 H GLN 60 -3.891 -9.796 0.139
501 HA GLN 60 HA GLN 60 -5.384 -11.991 -1.029
502 1HB GLN 60 2HB GLN 60 -4.688 -9.258 -2.118
503 2HB GLN 60 1HB GLN 60 -5.733 -10.422 -2.919
504 1HG GLN 60 2HG GLN 60 -7.325 -10.288 -1.105
505 2HG GLN 60 1HG GLN 60 -6.264 -9.185 -0.231
506 1HE2 GLN 60 1HE2 GLN 60 -6.671 -9.063 -3.690
507 2HE2 GLN 60 2HE2 GLN 60 -7.534 -7.563 -3.733
508 H GLN 61 H GLN 61 -2.217 -10.604 -1.227
509 HA GLN 61 HA GLN 61 -1.626 -11.770 -3.802
510 1HB GLN 61 2HB GLN 61 -0.731 -9.561 -3.107
511 2HB GLN 61 1HB GLN 61 0.213 -10.363 -1.863
512 1HG GLN 61 2HG GLN 61 1.435 -11.595 -3.577
513 2HG GLN 61 1HG GLN 61 0.486 -10.797 -4.829
514 1HE2 GLN 61 1HE2 GLN 61 2.294 -9.882 -5.775
515 2HE2 GLN 61 2HE2 GLN 61 3.154 -8.571 -5.053
516 H LYS 62 H LYS 62 -0.909 -12.443 -0.416
517 HA LYS 62 HA LYS 62 1.132 -14.343 -0.858
518 1HB LYS 62 2HB LYS 62 0.747 -13.319 1.344
519 2HB LYS 62 1HB LYS 62 -0.804 -14.144 1.459
520 1HG LYS 62 2HG LYS 62 0.346 -16.303 1.420
521 2HG LYS 62 1HG LYS 62 1.897 -15.472 1.328
522 1HD LYS 62 2HD LYS 62 1.457 -16.167 3.609
523 2HD LYS 62 1HD LYS 62 1.434 -14.406 3.498
524 1HE LYS 62 2HE LYS 62 -0.990 -14.414 3.474
525 2HE LYS 62 1HE LYS 62 -1.007 -16.177 3.486
526 1HZ LYS 62 1HZ LYS 62 0.128 -14.487 5.648
527 2HZ LYS 62 2HZ LYS 62 -0.024 -16.176 5.662
528 3HZ LYS 62 3HZ LYS 62 -1.408 -15.202 5.682
Start of MODEL 4
1 1H MET 1 1HT MET 1 -18.024 17.966 -2.297
2 2H MET 1 2HT MET 1 -18.455 16.820 -1.119
3 3H MET 1 3HT MET 1 -18.671 16.470 -2.764
4 HA MET 1 HA MET 1 -16.300 16.546 -3.128
5 1HB MET 1 2HB MET 1 -14.789 16.580 -1.176
6 2HB MET 1 1HB MET 1 -15.673 18.086 -1.358
7 1HG MET 1 2HG MET 1 -17.219 17.387 0.405
8 2HG MET 1 1HG MET 1 -16.318 15.883 0.588
9 1HE MET 1 1HE MET 1 -16.165 16.464 3.220
10 2HE MET 1 2HE MET 1 -17.005 17.988 2.939
11 3HE MET 1 3HE MET 1 -15.488 17.972 3.837
12 H GLY 2 H GLY 2 -15.197 14.614 -3.144
13 1HA GLY 2 2HA GLY 2 -15.362 12.405 -1.565
14 2HA GLY 2 1HA GLY 2 -16.847 12.332 -2.507
15 H ASN 3 H ASN 3 -13.637 11.451 -2.435
16 HA ASN 3 HA ASN 3 -13.122 11.791 -5.265
17 1HB ASN 3 2HB ASN 3 -11.326 12.159 -3.612
18 2HB ASN 3 1HB ASN 3 -11.425 10.463 -3.149
19 1HD2 ASN 3 1HD2 ASN 3 -10.614 8.895 -4.526
20 2HD2 ASN 3 2HD2 ASN 3 -9.590 9.275 -5.865
21 H ILE 4 H ILE 4 -14.443 10.441 -6.408
22 HA ILE 4 HA ILE 4 -14.100 7.567 -5.976
23 HB ILE 4 HB ILE 4 -15.683 7.227 -7.820
24 1HG1 ILE 4 2HG1 ILE 4 -15.099 9.411 -9.014
25 2HG1 ILE 4 1HG1 ILE 4 -16.798 8.960 -8.982
26 1HG2 ILE 4 1HG2 ILE 4 -16.541 7.348 -5.576
27 2HG2 ILE 4 2HG2 ILE 4 -17.695 8.074 -6.693
28 3HG2 ILE 4 3HG2 ILE 4 -16.677 9.102 -5.685
29 1HD1 ILE 4 1HD1 ILE 4 -17.140 10.538 -7.124
30 2HD1 ILE 4 2HD1 ILE 4 -16.572 11.317 -8.599
31 3HD1 ILE 4 3HD1 ILE 4 -15.454 11.035 -7.263
32 H ARG 5 H ARG 5 -13.488 6.243 -7.919
33 HA ARG 5 HA ARG 5 -11.817 5.634 -9.331
34 1HB ARG 5 2HB ARG 5 -12.771 7.427 -10.812
35 2HB ARG 5 1HB ARG 5 -11.633 8.561 -10.105
36 1HG ARG 5 2HG ARG 5 -10.694 6.050 -11.448
37 2HG ARG 5 1HG ARG 5 -11.067 7.505 -12.371
38 1HD ARG 5 2HD ARG 5 -9.187 7.572 -10.032
39 2HD ARG 5 1HD ARG 5 -8.632 7.103 -11.636
40 HE ARG 5 HE ARG 5 -9.457 9.346 -12.381
41 1HH1 ARG 5 1HH1 ARG 5 -8.754 8.857 -8.980
42 2HH1 ARG 5 2HH1 ARG 5 -8.166 10.476 -8.731
43 1HH2 ARG 5 1HH2 ARG 5 -8.640 11.473 -12.063
44 2HH2 ARG 5 2HH2 ARG 5 -8.076 11.941 -10.484
45 H THR 6 H THR 6 -9.995 4.970 -8.388
46 HA THR 6 HA THR 6 -8.029 6.837 -7.446
47 HB THR 6 HB THR 6 -9.675 6.988 -5.628
48 HG1 THR 6 1HG THR 6 -7.345 5.574 -4.801
49 1HG2 THR 6 1HG2 THR 6 -9.160 4.037 -5.253
50 2HG2 THR 6 2HG2 THR 6 -10.676 4.775 -5.770
51 3HG2 THR 6 3HG2 THR 6 -10.064 5.065 -4.141
52 H SER 7 H SER 7 -8.256 4.443 -9.185
53 HA SER 7 HA SER 7 -6.859 2.285 -8.001
54 1HB SER 7 2HB SER 7 -8.102 2.164 -10.169
55 2HB SER 7 1HB SER 7 -6.843 3.150 -10.906
56 HG SER 7 HG SER 7 -5.999 1.256 -11.311
57 H PHE 8 H PHE 8 -5.931 5.418 -8.822
58 HA PHE 8 HA PHE 8 -3.240 5.217 -9.485
59 1HB PHE 8 2HB PHE 8 -4.454 7.315 -9.624
60 2HB PHE 8 1HB PHE 8 -4.722 7.318 -7.887
61 HD1 PHE 8 1HD PHE 8 -3.449 8.767 -6.681
62 HD2 PHE 8 2HD PHE 8 -1.820 7.095 -10.239
63 HE1 PHE 8 1HE PHE 8 -1.403 10.096 -6.365
64 HE2 PHE 8 2HE PHE 8 0.231 8.419 -9.926
65 HZ PHE 8 HZ PHE 8 0.439 9.924 -7.986
66 H VAL 9 H VAL 9 -4.813 5.253 -6.293
67 HA VAL 9 HA VAL 9 -2.363 5.289 -4.838
68 HB VAL 9 HB VAL 9 -4.570 6.056 -3.915
69 1HG1 VAL 9 1HG1 VAL 9 -5.093 3.103 -3.641
70 2HG1 VAL 9 2HG1 VAL 9 -5.991 4.244 -4.642
71 3HG1 VAL 9 3HG1 VAL 9 -6.043 4.384 -2.885
72 1HG2 VAL 9 1HG2 VAL 9 -2.645 5.720 -2.485
73 2HG2 VAL 9 2HG2 VAL 9 -3.059 4.015 -2.302
74 3HG2 VAL 9 3HG2 VAL 9 -4.127 5.255 -1.647
75 H LYS 10 H LYS 10 -4.362 2.800 -6.199
76 HA LYS 10 HA LYS 10 -3.221 0.613 -4.776
77 1HB LYS 10 2HB LYS 10 -5.416 0.507 -5.929
78 2HB LYS 10 1HB LYS 10 -4.591 0.637 -7.475
79 1HG LYS 10 2HG LYS 10 -3.564 -1.488 -7.200
80 2HG LYS 10 1HG LYS 10 -4.097 -1.592 -5.520
81 1HD LYS 10 2HD LYS 10 -6.433 -1.642 -6.272
82 2HD LYS 10 1HD LYS 10 -5.888 -1.551 -7.949
83 1HE LYS 10 2HE LYS 10 -5.047 -3.743 -6.067
84 2HE LYS 10 1HE LYS 10 -6.477 -3.858 -7.090
85 1HZ LYS 10 1HZ LYS 10 -5.153 -3.724 -9.030
86 2HZ LYS 10 2HZ LYS 10 -4.417 -4.877 -8.026
87 3HZ LYS 10 3HZ LYS 10 -3.758 -3.323 -8.156
88 H ARG 11 H ARG 11 -2.544 2.231 -7.835
89 HA ARG 11 HA ARG 11 -0.393 0.594 -8.639
90 1HB ARG 11 2HB ARG 11 -1.380 2.113 -10.218
91 2HB ARG 11 1HB ARG 11 -1.005 3.497 -9.199
92 1HG ARG 11 2HG ARG 11 1.384 3.089 -9.535
93 2HG ARG 11 1HG ARG 11 0.997 1.726 -10.585
94 1HD ARG 11 2HD ARG 11 -0.007 3.150 -12.198
95 2HD ARG 11 1HD ARG 11 0.029 4.528 -11.097
96 HE ARG 11 HE ARG 11 2.614 4.051 -11.278
97 1HH1 ARG 11 1HH1 ARG 11 0.221 3.914 -13.837
98 2HH1 ARG 11 2HH1 ARG 11 1.314 4.475 -15.070
99 1HH2 ARG 11 1HH2 ARG 11 4.039 4.825 -12.877
100 2HH2 ARG 11 2HH2 ARG 11 3.501 4.973 -14.526
101 H ILE 12 H ILE 12 -0.535 3.565 -6.699
102 HA ILE 12 HA ILE 12 2.171 3.922 -6.191
103 HB ILE 12 HB ILE 12 -0.156 4.417 -4.323
104 1HG1 ILE 12 2HG1 ILE 12 1.350 6.285 -6.167
105 2HG1 ILE 12 1HG1 ILE 12 -0.272 5.654 -6.449
106 1HG2 ILE 12 1HG2 ILE 12 2.681 5.431 -4.161
107 2HG2 ILE 12 2HG2 ILE 12 1.911 4.293 -3.057
108 3HG2 ILE 12 3HG2 ILE 12 1.347 5.962 -3.139
109 1HD1 ILE 12 1HD1 ILE 12 0.571 7.476 -4.206
110 2HD1 ILE 12 2HD1 ILE 12 -1.046 6.810 -4.428
111 3HD1 ILE 12 3HD1 ILE 12 -0.380 7.920 -5.625
112 H ALA 13 H ALA 13 -0.196 1.985 -4.386
113 HA ALA 13 HA ALA 13 1.541 0.986 -2.438
114 1HB ALA 13 1HB ALA 13 -0.878 -0.377 -3.616
115 2HB ALA 13 2HB ALA 13 -0.901 0.808 -2.311
116 3HB ALA 13 3HB ALA 13 -0.114 -0.751 -2.071
117 H LYS 14 H LYS 14 0.753 -0.247 -5.671
118 HA LYS 14 HA LYS 14 2.177 -2.677 -5.429
119 1HB LYS 14 2HB LYS 14 0.454 -2.107 -7.200
120 2HB LYS 14 1HB LYS 14 1.712 -1.173 -8.003
121 1HG LYS 14 2HG LYS 14 3.080 -3.367 -7.875
122 2HG LYS 14 1HG LYS 14 1.512 -4.129 -7.615
123 1HD LYS 14 2HD LYS 14 1.906 -4.239 -9.939
124 2HD LYS 14 1HD LYS 14 0.748 -2.928 -9.717
125 1HE LYS 14 2HE LYS 14 2.486 -2.287 -11.299
126 2HE LYS 14 1HE LYS 14 2.560 -1.295 -9.845
127 1HZ LYS 14 1HZ LYS 14 4.263 -3.695 -10.197
128 2HZ LYS 14 2HZ LYS 14 4.460 -2.422 -9.098
129 3HZ LYS 14 3HZ LYS 14 4.740 -2.163 -10.745
130 H GLU 15 H GLU 15 3.075 0.450 -6.884
131 HA GLU 15 HA GLU 15 5.692 -0.413 -7.593
132 1HB GLU 15 2HB GLU 15 4.566 2.380 -7.327
133 2HB GLU 15 1HB GLU 15 6.142 1.996 -8.003
134 1HG GLU 15 2HG GLU 15 4.933 0.567 -9.695
135 2HG GLU 15 1HG GLU 15 3.439 1.298 -9.109
136 H MET 16 H MET 16 4.284 0.761 -4.702
137 HA MET 16 HA MET 16 6.663 1.595 -3.394
138 1HB MET 16 2HB MET 16 4.454 2.259 -2.594
139 2HB MET 16 1HB MET 16 4.048 0.578 -2.274
140 1HG MET 16 2HG MET 16 5.811 0.477 -0.583
141 2HG MET 16 1HG MET 16 6.199 2.170 -0.892
142 1HE MET 16 1HE MET 16 4.553 4.186 -0.357
143 2HE MET 16 2HE MET 16 2.934 3.978 0.313
144 3HE MET 16 3HE MET 16 3.288 3.426 -1.324
145 H ILE 17 H ILE 17 4.816 -1.453 -3.369
146 HA ILE 17 HA ILE 17 6.734 -2.801 -1.717
147 HB ILE 17 HB ILE 17 4.594 -4.049 -3.457
148 1HG1 ILE 17 2HG1 ILE 17 4.410 -3.170 -0.566
149 2HG1 ILE 17 1HG1 ILE 17 3.680 -2.320 -1.922
150 1HG2 ILE 17 1HG2 ILE 17 4.697 -5.878 -1.817
151 2HG2 ILE 17 2HG2 ILE 17 6.020 -5.053 -0.993
152 3HG2 ILE 17 3HG2 ILE 17 6.238 -5.641 -2.641
153 1HD1 ILE 17 1HD1 ILE 17 3.013 -5.115 -1.026
154 2HD1 ILE 17 2HD1 ILE 17 2.273 -4.259 -2.380
155 3HD1 ILE 17 3HD1 ILE 17 2.046 -3.669 -0.733
156 H GLU 18 H GLU 18 6.224 -2.345 -5.106
157 HA GLU 18 HA GLU 18 7.587 -2.569 -6.891
158 1HB GLU 18 2HB GLU 18 9.475 -2.024 -5.410
159 2HB GLU 18 1HB GLU 18 9.628 -3.723 -4.985
160 1HG GLU 18 2HG GLU 18 10.080 -4.235 -7.360
161 2HG GLU 18 1HG GLU 18 10.032 -2.509 -7.711
162 H THR 19 H THR 19 8.068 -5.429 -4.810
163 HA THR 19 HA THR 19 7.130 -7.119 -7.006
164 HB THR 19 HB THR 19 9.620 -6.932 -7.199
165 HG1 THR 19 1HG THR 19 9.422 -8.863 -7.990
166 1HG2 THR 19 1HG2 THR 19 11.026 -8.060 -5.525
167 2HG2 THR 19 2HG2 THR 19 9.604 -8.316 -4.512
168 3HG2 THR 19 3HG2 THR 19 10.174 -6.679 -4.838
169 H HIS 20 H HIS 20 7.574 -9.591 -5.912
170 HA HIS 20 HA HIS 20 5.833 -9.533 -3.569
171 1HB HIS 20 2HB HIS 20 6.807 -11.782 -5.334
172 2HB HIS 20 1HB HIS 20 5.884 -12.058 -3.863
173 HD1 HIS 20 1HD HIS 20 3.642 -12.775 -4.649
174 HD2 HIS 20 2HD HIS 20 5.074 -9.499 -6.783
175 HE1 HIS 20 1HE HIS 20 1.764 -12.079 -6.177
176 HE2 HIS 20 2HE HIS 20 2.701 -10.180 -7.555
177 HA PRO 21 HA PRO 21 9.621 -10.058 -1.208
178 1HB PRO 21 2HB PRO 21 8.741 -9.005 1.074
179 2HB PRO 21 1HB PRO 21 9.054 -7.983 -0.333
180 1HG PRO 21 2HG PRO 21 6.453 -8.977 0.746
181 2HG PRO 21 1HG PRO 21 6.849 -7.395 0.049
182 1HD PRO 21 2HD PRO 21 5.606 -9.496 -1.301
183 2HD PRO 21 1HD PRO 21 6.406 -8.110 -2.063
184 H GLY 22 H GLY 22 10.027 -10.980 1.083
185 1HA GLY 22 2HA GLY 22 8.565 -13.502 1.259
186 2HA GLY 22 1HA GLY 22 10.059 -13.101 2.096
187 H LYS 23 H LYS 23 8.409 -10.458 2.645
188 HA LYS 23 HA LYS 23 7.581 -11.309 5.274
189 1HB LYS 23 2HB LYS 23 8.496 -8.910 4.144
190 2HB LYS 23 1HB LYS 23 6.833 -8.596 4.618
191 1HG LYS 23 2HG LYS 23 8.271 -7.986 6.425
192 2HG LYS 23 1HG LYS 23 7.375 -9.434 6.887
193 1HD LYS 23 2HD LYS 23 9.684 -9.662 7.565
194 2HD LYS 23 1HD LYS 23 9.337 -10.803 6.266
195 1HE LYS 23 2HE LYS 23 10.377 -9.314 4.650
196 2HE LYS 23 1HE LYS 23 10.671 -8.120 5.915
197 1HZ LYS 23 1HZ LYS 23 12.126 -9.691 7.019
198 2HZ LYS 23 2HZ LYS 23 12.648 -9.417 5.430
199 3HZ LYS 23 3HZ LYS 23 11.831 -10.852 5.819
200 H PHE 24 H PHE 24 5.737 -12.473 5.251
201 HA PHE 24 HA PHE 24 3.393 -11.275 3.928
202 1HB PHE 24 2HB PHE 24 2.446 -13.503 3.759
203 2HB PHE 24 1HB PHE 24 4.055 -13.500 3.050
204 HD1 PHE 24 1HD PHE 24 5.984 -14.348 4.547
205 HD2 PHE 24 2HD PHE 24 1.872 -15.084 5.347
206 HE1 PHE 24 1HE PHE 24 6.605 -16.261 5.964
207 HE2 PHE 24 2HE PHE 24 2.486 -16.996 6.768
208 HZ PHE 24 HZ PHE 24 4.856 -17.588 7.078
209 H THR 25 H THR 25 4.523 -10.670 6.556
210 HA THR 25 HA THR 25 2.775 -11.874 8.510
211 HB THR 25 HB THR 25 4.654 -9.532 8.878
212 HG1 THR 25 1HG THR 25 6.261 -11.045 9.295
213 1HG2 THR 25 1HG2 THR 25 3.587 -11.594 10.812
214 2HG2 THR 25 2HG2 THR 25 3.071 -9.911 10.711
215 3HG2 THR 25 3HG2 THR 25 4.718 -10.300 11.208
216 H ASP 26 H ASP 26 0.806 -11.127 9.002
217 HA ASP 26 HA ASP 26 -0.175 -8.836 7.542
218 1HB ASP 26 2HB ASP 26 -2.386 -9.535 8.267
219 2HB ASP 26 1HB ASP 26 -1.487 -10.924 7.664
220 H ASP 27 H ASP 27 1.482 -8.862 10.261
221 HA ASP 27 HA ASP 27 -0.121 -7.154 11.917
222 1HB ASP 27 2HB ASP 27 1.829 -8.592 12.702
223 2HB ASP 27 1HB ASP 27 2.893 -7.401 11.960
224 H PHE 28 H PHE 28 -0.156 -4.920 11.977
225 HA PHE 28 HA PHE 28 0.353 -3.628 9.515
226 1HB PHE 28 2HB PHE 28 -0.493 -2.612 12.216
227 2HB PHE 28 1HB PHE 28 -0.222 -1.520 10.862
228 HD1 PHE 28 1HD PHE 28 -1.725 -1.449 9.003
229 HD2 PHE 28 2HD PHE 28 -2.344 -4.208 12.178
230 HE1 PHE 28 1HE PHE 28 -4.000 -1.888 8.172
231 HE2 PHE 28 2HE PHE 28 -4.618 -4.654 11.356
232 HZ PHE 28 HZ PHE 28 -5.451 -3.493 9.351
233 H ASP 29 H ASP 29 2.300 -4.048 12.324
234 HA ASP 29 HA ASP 29 4.119 -1.914 11.948
235 1HB ASP 29 2HB ASP 29 4.301 -2.975 14.017
236 2HB ASP 29 1HB ASP 29 4.242 -4.586 13.311
237 H THR 30 H THR 30 3.733 -5.007 10.428
238 HA THR 30 HA THR 30 6.284 -5.258 9.248
239 HB THR 30 HB THR 30 3.665 -6.347 8.207
240 HG1 THR 30 1HG THR 30 3.669 -7.474 9.981
241 1HG2 THR 30 1HG2 THR 30 5.062 -8.129 7.275
242 2HG2 THR 30 2HG2 THR 30 6.505 -7.327 7.897
243 3HG2 THR 30 3HG2 THR 30 5.537 -6.552 6.641
244 H ASN 31 H ASN 31 3.187 -4.332 7.713
245 HA ASN 31 HA ASN 31 4.395 -3.509 5.306
246 1HB ASN 31 2HB ASN 31 2.186 -2.398 4.853
247 2HB ASN 31 1HB ASN 31 2.082 -4.108 5.265
248 1HD2 ASN 31 1HD2 ASN 31 1.474 -0.859 6.337
249 2HD2 ASN 31 2HD2 ASN 31 0.429 -1.275 7.646
250 H LYS 32 H LYS 32 3.800 -1.836 8.312
251 HA LYS 32 HA LYS 32 4.027 0.811 7.407
252 1HB LYS 32 2HB LYS 32 3.302 0.121 9.697
253 2HB LYS 32 1HB LYS 32 4.975 -0.275 10.067
254 1HG LYS 32 2HG LYS 32 5.597 2.070 9.661
255 2HG LYS 32 1HG LYS 32 3.902 2.449 9.360
256 1HD LYS 32 2HD LYS 32 4.415 3.065 11.616
257 2HD LYS 32 1HD LYS 32 3.389 1.630 11.663
258 1HE LYS 32 2HE LYS 32 5.362 0.229 11.993
259 2HE LYS 32 1HE LYS 32 6.392 1.658 11.935
260 1HZ LYS 32 1HZ LYS 32 5.250 2.497 13.908
261 2HZ LYS 32 2HZ LYS 32 5.973 0.991 14.203
262 3HZ LYS 32 3HZ LYS 32 4.299 1.094 13.966
263 H LYS 33 H LYS 33 6.506 -1.514 8.428
264 HA LYS 33 HA LYS 33 8.667 0.321 8.051
265 1HB LYS 33 2HB LYS 33 8.631 -2.685 8.301
266 2HB LYS 33 1HB LYS 33 10.104 -1.731 8.189
267 1HG LYS 33 2HG LYS 33 9.354 -0.501 10.238
268 2HG LYS 33 1HG LYS 33 8.054 -1.686 10.389
269 1HD LYS 33 2HD LYS 33 11.008 -2.306 10.350
270 2HD LYS 33 1HD LYS 33 9.988 -2.263 11.788
271 1HE LYS 33 2HE LYS 33 9.577 -4.103 9.437
272 2HE LYS 33 1HE LYS 33 10.388 -4.553 10.938
273 1HZ LYS 33 1HZ LYS 33 8.061 -5.239 10.913
274 2HZ LYS 33 2HZ LYS 33 7.573 -3.628 10.727
275 3HZ LYS 33 3HZ LYS 33 8.357 -4.114 12.146
276 H LEU 34 H LEU 34 6.951 -1.911 6.000
277 HA LEU 34 HA LEU 34 8.848 -1.991 3.891
278 1HB LEU 34 2HB LEU 34 5.850 -2.361 3.811
279 2HB LEU 34 1HB LEU 34 6.943 -2.733 2.492
280 HG LEU 34 HG LEU 34 6.945 -4.084 5.195
281 1HD1 LEU 34 1HD1 LEU 34 4.979 -4.655 3.855
282 2HD1 LEU 34 2HD1 LEU 34 6.079 -6.025 4.003
283 3HD1 LEU 34 3HD1 LEU 34 6.027 -5.095 2.505
284 1HD2 LEU 34 1HD2 LEU 34 8.531 -5.638 4.180
285 2HD2 LEU 34 2HD2 LEU 34 9.169 -3.995 4.183
286 3HD2 LEU 34 3HD2 LEU 34 8.523 -4.688 2.694
287 H VAL 35 H VAL 35 5.970 0.013 4.458
288 HA VAL 35 HA VAL 35 6.032 1.580 2.169
289 HB VAL 35 HB VAL 35 5.249 2.436 4.964
290 1HG1 VAL 35 1HG1 VAL 35 5.594 4.366 3.541
291 2HG1 VAL 35 2HG1 VAL 35 3.872 4.136 3.840
292 3HG1 VAL 35 3HG1 VAL 35 4.571 3.658 2.293
293 1HG2 VAL 35 1HG2 VAL 35 3.990 0.494 4.224
294 2HG2 VAL 35 2HG2 VAL 35 3.581 1.315 2.715
295 3HG2 VAL 35 3HG2 VAL 35 2.959 1.926 4.249
296 H GLU 36 H GLU 36 7.477 2.315 5.332
297 HA GLU 36 HA GLU 36 8.544 4.793 4.528
298 1HB GLU 36 2HB GLU 36 8.009 4.121 6.864
299 2HB GLU 36 1HB GLU 36 9.412 3.063 6.847
300 1HG GLU 36 2HG GLU 36 10.907 4.836 6.840
301 2HG GLU 36 1HG GLU 36 9.699 5.977 6.249
302 H GLU 37 H GLU 37 9.795 1.552 4.344
303 HA GLU 37 HA GLU 37 12.537 2.205 4.045
304 1HB GLU 37 2HB GLU 37 11.764 -0.059 4.623
305 2HB GLU 37 1HB GLU 37 11.029 -0.212 3.035
306 1HG GLU 37 2HG GLU 37 13.214 -0.073 1.987
307 2HG GLU 37 1HG GLU 37 13.973 0.146 3.562
308 H PHE 38 H PHE 38 9.959 1.561 1.678
309 HA PHE 38 HA PHE 38 11.750 2.143 -0.529
310 1HB PHE 38 2HB PHE 38 8.830 1.377 -0.420
311 2HB PHE 38 1HB PHE 38 9.678 1.734 -1.920
312 HD1 PHE 38 1HD PHE 38 9.432 -0.609 0.905
313 HD2 PHE 38 2HD PHE 38 11.149 0.161 -2.909
314 HE1 PHE 38 1HE PHE 38 10.144 -2.960 0.756
315 HE2 PHE 38 2HE PHE 38 11.867 -2.186 -3.065
316 HZ PHE 38 HZ PHE 38 11.363 -3.750 -1.233
317 H SER 39 H SER 39 8.461 3.334 0.142
318 HA SER 39 HA SER 39 9.345 6.064 -0.407
319 1HB SER 39 2HB SER 39 8.548 4.967 -2.556
320 2HB SER 39 1HB SER 39 6.958 4.838 -1.808
321 HG SER 39 HG SER 39 8.360 7.111 -2.669
322 H THR 40 H THR 40 8.729 7.104 1.380
323 HA THR 40 HA THR 40 6.657 6.019 3.046
324 HB THR 40 HB THR 40 8.709 6.901 4.049
325 HG1 THR 40 1HG THR 40 7.688 8.068 5.699
326 1HG2 THR 40 1HG2 THR 40 9.137 9.306 4.145
327 2HG2 THR 40 2HG2 THR 40 7.758 9.601 3.089
328 3HG2 THR 40 3HG2 THR 40 9.165 8.727 2.480
329 H VAL 41 H VAL 41 7.049 8.792 0.930
330 HA VAL 41 HA VAL 41 5.591 10.294 0.063
331 HB VAL 41 HB VAL 41 3.439 8.383 0.996
332 1HG1 VAL 41 1HG1 VAL 41 2.073 9.414 -0.755
333 2HG1 VAL 41 2HG1 VAL 41 3.375 10.551 -1.103
334 3HG1 VAL 41 3HG1 VAL 41 2.562 10.591 0.463
335 1HG2 VAL 41 1HG2 VAL 41 3.517 7.486 -1.278
336 2HG2 VAL 41 2HG2 VAL 41 5.062 7.277 -0.453
337 3HG2 VAL 41 3HG2 VAL 41 4.870 8.551 -1.655
338 H SER 42 H SER 42 5.722 12.135 1.185
339 HA SER 42 HA SER 42 4.963 12.453 3.882
340 1HB SER 42 2HB SER 42 6.557 13.961 2.745
341 2HB SER 42 1HB SER 42 5.243 14.590 1.751
342 HG SER 42 HG SER 42 5.696 14.908 4.523
343 H THR 43 H THR 43 2.959 11.978 4.467
344 HA THR 43 HA THR 43 0.791 13.612 3.396
345 HB THR 43 HB THR 43 -0.720 11.555 3.608
346 HG1 THR 43 1HG THR 43 1.810 10.237 3.399
347 1HG2 THR 43 1HG2 THR 43 -0.135 12.541 1.447
348 2HG2 THR 43 2HG2 THR 43 -0.232 10.783 1.342
349 3HG2 THR 43 3HG2 THR 43 1.343 11.576 1.404
350 H LYS 44 H LYS 44 -0.852 14.033 4.922
351 HA LYS 44 HA LYS 44 -0.153 14.302 7.574
352 1HB LYS 44 2HB LYS 44 -2.070 15.417 6.390
353 2HB LYS 44 1HB LYS 44 -2.973 13.918 6.551
354 1HG LYS 44 2HG LYS 44 -3.573 15.579 8.254
355 2HG LYS 44 1HG LYS 44 -2.923 14.095 8.955
356 1HD LYS 44 2HD LYS 44 -0.876 15.110 9.483
357 2HD LYS 44 1HD LYS 44 -1.171 16.470 8.401
358 1HE LYS 44 2HE LYS 44 -1.404 17.041 10.803
359 2HE LYS 44 1HE LYS 44 -2.863 17.341 9.863
360 1HZ LYS 44 1HZ LYS 44 -3.314 16.292 12.012
361 2HZ LYS 44 2HZ LYS 44 -2.404 14.937 11.554
362 3HZ LYS 44 3HZ LYS 44 -3.829 15.329 10.715
363 H HIS 45 H HIS 45 -2.614 11.959 6.464
364 HA HIS 45 HA HIS 45 -1.193 9.812 7.760
365 1HB HIS 45 2HB HIS 45 -3.689 10.936 8.906
366 2HB HIS 45 1HB HIS 45 -3.576 9.178 8.832
367 HD1 HIS 45 1HD HIS 45 -3.214 11.464 11.311
368 HD2 HIS 45 2HD HIS 45 -0.511 8.739 9.707
369 HE1 HIS 45 1HE HIS 45 -1.462 11.114 13.084
370 HE2 HIS 45 2HE HIS 45 0.280 9.664 11.980
371 H LEU 46 H LEU 46 -2.276 10.741 5.094
372 HA LEU 46 HA LEU 46 -4.197 8.847 4.243
373 1HB LEU 46 2HB LEU 46 -3.654 10.896 2.981
374 2HB LEU 46 1HB LEU 46 -2.056 10.263 2.641
375 HG LEU 46 HG LEU 46 -3.099 8.408 1.359
376 1HD1 LEU 46 1HD1 LEU 46 -5.642 9.950 1.852
377 2HD1 LEU 46 2HD1 LEU 46 -5.263 8.338 2.458
378 3HD1 LEU 46 3HD1 LEU 46 -5.464 8.604 0.726
379 1HD2 LEU 46 1HD2 LEU 46 -3.845 11.194 0.487
380 2HD2 LEU 46 2HD2 LEU 46 -3.769 9.781 -0.563
381 3HD2 LEU 46 3HD2 LEU 46 -2.302 10.387 0.206
382 H ARG 47 H ARG 47 -0.750 8.801 4.648
383 HA ARG 47 HA ARG 47 0.021 6.509 3.315
384 1HB ARG 47 2HB ARG 47 1.563 8.027 4.444
385 2HB ARG 47 1HB ARG 47 0.919 7.547 6.006
386 1HG ARG 47 2HG ARG 47 1.710 5.224 5.520
387 2HG ARG 47 1HG ARG 47 2.520 5.876 4.092
388 1HD ARG 47 2HD ARG 47 3.000 6.708 6.950
389 2HD ARG 47 1HD ARG 47 4.072 5.718 5.961
390 HE ARG 47 HE ARG 47 4.297 7.715 4.494
391 1HH1 ARG 47 1HH1 ARG 47 3.305 8.126 7.836
392 2HH1 ARG 47 2HH1 ARG 47 3.966 9.730 7.962
393 1HH2 ARG 47 1HH2 ARG 47 5.163 9.825 4.680
394 2HH2 ARG 47 2HH2 ARG 47 5.057 10.672 6.194
395 H ASN 48 H ASN 48 -1.736 6.839 6.339
396 HA ASN 48 HA ASN 48 -1.363 4.196 7.263
397 1HB ASN 48 2HB ASN 48 -3.518 6.224 7.890
398 2HB ASN 48 1HB ASN 48 -3.344 4.685 8.728
399 1HD2 ASN 48 1HD2 ASN 48 -2.948 5.593 10.704
400 2HD2 ASN 48 2HD2 ASN 48 -1.475 6.422 11.083
401 H LYS 49 H LYS 49 -3.760 5.697 5.175
402 HA LYS 49 HA LYS 49 -5.486 3.439 5.029
403 1HB LYS 49 2HB LYS 49 -5.110 5.857 3.270
404 2HB LYS 49 1HB LYS 49 -6.247 4.583 2.861
405 1HG LYS 49 2HG LYS 49 -7.449 4.965 4.945
406 2HG LYS 49 1HG LYS 49 -6.291 6.220 5.389
407 1HD LYS 49 2HD LYS 49 -6.999 7.624 3.616
408 2HD LYS 49 1HD LYS 49 -7.929 6.325 2.865
409 1HE LYS 49 2HE LYS 49 -8.528 7.476 5.583
410 2HE LYS 49 1HE LYS 49 -9.305 8.013 4.094
411 1HZ LYS 49 1HZ LYS 49 -9.381 5.220 5.122
412 2HZ LYS 49 2HZ LYS 49 -10.220 5.828 3.777
413 3HZ LYS 49 3HZ LYS 49 -10.620 6.357 5.338
414 H ILE 50 H ILE 50 -2.779 4.597 3.085
415 HA ILE 50 HA ILE 50 -2.857 2.603 1.098
416 HB ILE 50 HB ILE 50 -0.411 4.027 2.164
417 1HG1 ILE 50 2HG1 ILE 50 -2.257 4.833 -0.096
418 2HG1 ILE 50 1HG1 ILE 50 -2.209 5.596 1.489
419 1HG2 ILE 50 1HG2 ILE 50 0.503 3.622 -0.090
420 2HG2 ILE 50 2HG2 ILE 50 -0.939 2.687 -0.488
421 3HG2 ILE 50 3HG2 ILE 50 0.156 2.125 0.776
422 1HD1 ILE 50 1HD1 ILE 50 0.085 6.303 1.076
423 2HD1 ILE 50 2HD1 ILE 50 -1.020 6.912 -0.157
424 3HD1 ILE 50 3HD1 ILE 50 0.032 5.543 -0.514
425 H ALA 51 H ALA 51 -1.045 2.842 4.137
426 HA ALA 51 HA ALA 51 0.293 0.392 3.988
427 1HB ALA 51 1HB ALA 51 0.911 2.153 5.556
428 2HB ALA 51 2HB ALA 51 0.627 0.631 6.399
429 3HB ALA 51 3HB ALA 51 -0.593 1.904 6.443
430 H GLY 52 H GLY 52 -2.835 1.223 5.448
431 1HA GLY 52 2HA GLY 52 -3.432 -1.329 6.487
432 2HA GLY 52 1HA GLY 52 -4.609 -0.084 6.085
433 H TYR 53 H TYR 53 -3.905 0.082 3.295
434 HA TYR 53 HA TYR 53 -5.521 -1.998 2.261
435 1HB TYR 53 2HB TYR 53 -5.276 0.276 1.242
436 2HB TYR 53 1HB TYR 53 -3.658 -0.177 0.722
437 HD1 TYR 53 1HD TYR 53 -7.076 -1.710 0.565
438 HD2 TYR 53 2HD TYR 53 -3.504 -0.699 -1.510
439 HE1 TYR 53 1HE TYR 53 -8.017 -2.660 -1.498
440 HE2 TYR 53 2HE TYR 53 -4.434 -1.649 -3.581
441 HH TYR 53 HH TYR 53 -7.731 -2.470 -3.921
442 H ILE 54 H ILE 54 -2.030 -1.490 2.411
443 HA ILE 54 HA ILE 54 -1.169 -3.619 0.826
444 HB ILE 54 HB ILE 54 0.120 -2.608 3.368
445 1HG1 ILE 54 2HG1 ILE 54 0.656 -1.829 0.493
446 2HG1 ILE 54 1HG1 ILE 54 -0.244 -0.851 1.651
447 1HG2 ILE 54 1HG2 ILE 54 0.991 -4.781 2.722
448 2HG2 ILE 54 2HG2 ILE 54 2.197 -3.528 2.426
449 3HG2 ILE 54 3HG2 ILE 54 1.277 -4.201 1.081
450 1HD1 ILE 54 1HD1 ILE 54 2.636 -1.675 1.909
451 2HD1 ILE 54 2HD1 ILE 54 1.734 -0.683 3.056
452 3HD1 ILE 54 3HD1 ILE 54 2.049 -0.082 1.425
453 H THR 55 H THR 55 -1.793 -3.543 4.329
454 HA THR 55 HA THR 55 -1.309 -6.177 4.967
455 HB THR 55 HB THR 55 -3.662 -4.752 6.162
456 HG1 THR 55 1HG THR 55 -0.958 -4.114 6.803
457 1HG2 THR 55 1HG2 THR 55 -2.999 -6.944 7.035
458 2HG2 THR 55 2HG2 THR 55 -2.731 -5.673 8.229
459 3HG2 THR 55 3HG2 THR 55 -1.370 -6.333 7.323
460 H ARG 56 H ARG 56 -4.296 -4.725 3.705
461 HA ARG 56 HA ARG 56 -5.858 -7.075 3.733
462 1HB ARG 56 2HB ARG 56 -6.095 -4.700 1.869
463 2HB ARG 56 1HB ARG 56 -7.344 -5.893 2.192
464 1HG ARG 56 2HG ARG 56 -7.474 -5.166 4.507
465 2HG ARG 56 1HG ARG 56 -6.184 -3.994 4.226
466 1HD ARG 56 2HD ARG 56 -7.646 -2.943 2.481
467 2HD ARG 56 1HD ARG 56 -8.941 -4.017 3.008
468 HE ARG 56 HE ARG 56 -7.940 -2.670 5.255
469 1HH1 ARG 56 1HH1 ARG 56 -9.774 -2.018 2.338
470 2HH1 ARG 56 2HH1 ARG 56 -10.557 -0.615 3.000
471 1HH2 ARG 56 1HH2 ARG 56 -9.000 -0.825 6.125
472 2HH2 ARG 56 2HH2 ARG 56 -10.122 0.058 5.127
473 H ILE 57 H ILE 57 -3.772 -5.628 1.269
474 HA ILE 57 HA ILE 57 -4.268 -7.424 -0.822
475 HB ILE 57 HB ILE 57 -1.713 -5.952 -0.150
476 1HG1 ILE 57 2HG1 ILE 57 -3.930 -5.289 -2.103
477 2HG1 ILE 57 1HG1 ILE 57 -3.673 -4.505 -0.549
478 1HG2 ILE 57 1HG2 ILE 57 -2.517 -7.298 -2.729
479 2HG2 ILE 57 2HG2 ILE 57 -1.253 -7.840 -1.624
480 3HG2 ILE 57 3HG2 ILE 57 -1.074 -6.313 -2.487
481 1HD1 ILE 57 1HD1 ILE 57 -2.831 -3.144 -2.369
482 2HD1 ILE 57 2HD1 ILE 57 -1.774 -4.461 -2.880
483 3HD1 ILE 57 3HD1 ILE 57 -1.515 -3.675 -1.323
484 H ILE 58 H ILE 58 -1.966 -7.592 1.876
485 HA ILE 58 HA ILE 58 -0.614 -9.927 1.157
486 HB ILE 58 HB ILE 58 -1.339 -8.985 3.942
487 1HG1 ILE 58 2HG1 ILE 58 1.179 -8.545 2.321
488 2HG1 ILE 58 1HG1 ILE 58 -0.072 -7.336 2.589
489 1HG2 ILE 58 1HG2 ILE 58 0.535 -10.340 4.709
490 2HG2 ILE 58 2HG2 ILE 58 0.814 -10.905 3.061
491 3HG2 ILE 58 3HG2 ILE 58 -0.672 -11.342 3.903
492 1HD1 ILE 58 1HD1 ILE 58 1.627 -8.608 4.723
493 2HD1 ILE 58 2HD1 ILE 58 0.384 -7.385 4.980
494 3HD1 ILE 58 3HD1 ILE 58 1.833 -6.988 4.057
495 H SER 59 H SER 59 -3.641 -9.497 2.929
496 HA SER 59 HA SER 59 -4.088 -12.224 3.517
497 1HB SER 59 2HB SER 59 -5.191 -10.178 4.575
498 2HB SER 59 1HB SER 59 -6.235 -10.128 3.157
499 HG SER 59 HG SER 59 -5.981 -12.222 5.063
500 H GLN 60 H GLN 60 -4.717 -10.268 0.684
501 HA GLN 60 HA GLN 60 -6.455 -12.215 -0.567
502 1HB GLN 60 2HB GLN 60 -5.042 -9.882 -1.866
503 2HB GLN 60 1HB GLN 60 -6.446 -10.744 -2.474
504 1HG GLN 60 2HG GLN 60 -7.815 -9.850 -0.711
505 2HG GLN 60 1HG GLN 60 -6.409 -9.091 0.039
506 1HE2 GLN 60 1HE2 GLN 60 -8.844 -7.830 -0.909
507 2HE2 GLN 60 2HE2 GLN 60 -8.363 -6.692 -2.122
508 H GLN 61 H GLN 61 -3.090 -11.441 -0.473
509 HA GLN 61 HA GLN 61 -2.315 -12.436 -2.986
510 1HB GLN 61 2HB GLN 61 -1.060 -10.895 -1.311
511 2HB GLN 61 1HB GLN 61 -0.479 -12.401 -0.616
512 1HG GLN 61 2HG GLN 61 1.130 -11.495 -2.179
513 2HG GLN 61 1HG GLN 61 0.487 -13.031 -2.767
514 1HE2 GLN 61 1HE2 GLN 61 0.502 -9.577 -3.194
515 2HE2 GLN 61 2HE2 GLN 61 -0.200 -9.563 -4.774
516 H LYS 62 H LYS 62 -1.725 -13.885 0.230
517 HA LYS 62 HA LYS 62 -2.054 -16.526 -0.974
518 1HB LYS 62 2HB LYS 62 0.352 -16.042 -1.083
519 2HB LYS 62 1HB LYS 62 0.365 -15.699 0.641
520 1HG LYS 62 2HG LYS 62 -0.111 -17.978 1.170
521 2HG LYS 62 1HG LYS 62 -0.382 -18.365 -0.530
522 1HD LYS 62 2HD LYS 62 1.811 -19.138 0.189
523 2HD LYS 62 1HD LYS 62 1.966 -17.857 -1.013
524 1HE LYS 62 2HE LYS 62 2.396 -16.235 0.768
525 2HE LYS 62 1HE LYS 62 2.225 -17.510 1.975
526 1HZ LYS 62 1HZ LYS 62 4.275 -17.468 -0.176
527 2HZ LYS 62 2HZ LYS 62 4.134 -18.627 1.053
528 3HZ LYS 62 3HZ LYS 62 4.553 -17.031 1.437
Start of MODEL 5
1 1H MET 1 1HT MET 1 -18.382 8.183 -16.340
2 2H MET 1 2HT MET 1 -18.217 8.824 -17.900
3 3H MET 1 3HT MET 1 -19.594 9.182 -16.979
4 HA MET 1 HA MET 1 -18.076 11.046 -17.033
5 1HB MET 1 2HB MET 1 -19.471 10.709 -15.044
6 2HB MET 1 1HB MET 1 -18.254 9.650 -14.345
7 1HG MET 1 2HG MET 1 -16.698 11.488 -14.177
8 2HG MET 1 1HG MET 1 -17.840 12.560 -14.985
9 1HE MET 1 1HE MET 1 -17.477 14.292 -12.972
10 2HE MET 1 2HE MET 1 -16.386 13.157 -12.182
11 3HE MET 1 3HE MET 1 -17.717 13.876 -11.274
12 H GLY 2 H GLY 2 -16.018 11.845 -16.900
13 1HA GLY 2 2HA GLY 2 -13.889 9.860 -16.901
14 2HA GLY 2 1HA GLY 2 -13.736 11.559 -17.335
15 H ASN 3 H ASN 3 -11.729 10.970 -15.926
16 HA ASN 3 HA ASN 3 -10.527 11.433 -14.046
17 1HB ASN 3 2HB ASN 3 -13.027 12.898 -13.142
18 2HB ASN 3 1HB ASN 3 -11.414 13.093 -12.468
19 1HD2 ASN 3 1HD2 ASN 3 -10.023 13.070 -14.992
20 2HD2 ASN 3 2HD2 ASN 3 -10.405 14.562 -15.785
21 H ILE 4 H ILE 4 -11.844 11.772 -11.364
22 HA ILE 4 HA ILE 4 -12.252 10.544 -9.528
23 HB ILE 4 HB ILE 4 -14.327 9.240 -9.534
24 1HG1 ILE 4 2HG1 ILE 4 -14.409 9.767 -12.514
25 2HG1 ILE 4 1HG1 ILE 4 -14.105 8.194 -11.780
26 1HG2 ILE 4 1HG2 ILE 4 -14.464 11.835 -11.050
27 2HG2 ILE 4 2HG2 ILE 4 -14.409 11.641 -9.296
28 3HG2 ILE 4 3HG2 ILE 4 -15.810 11.071 -10.204
29 1HD1 ILE 4 1HD1 ILE 4 -16.631 9.806 -11.486
30 2HD1 ILE 4 2HD1 ILE 4 -16.329 8.208 -10.802
31 3HD1 ILE 4 3HD1 ILE 4 -16.406 8.420 -12.550
32 H ARG 5 H ARG 5 -13.372 7.808 -9.422
33 HA ARG 5 HA ARG 5 -12.639 5.695 -9.105
34 1HB ARG 5 2HB ARG 5 -10.666 6.441 -11.266
35 2HB ARG 5 1HB ARG 5 -10.610 4.882 -10.465
36 1HG ARG 5 2HG ARG 5 -11.795 4.562 -12.474
37 2HG ARG 5 1HG ARG 5 -12.995 4.540 -11.181
38 1HD ARG 5 2HD ARG 5 -13.516 6.897 -11.667
39 2HD ARG 5 1HD ARG 5 -12.360 6.861 -12.995
40 HE ARG 5 HE ARG 5 -14.640 5.009 -12.999
41 1HH1 ARG 5 1HH1 ARG 5 -12.960 7.757 -14.358
42 2HH1 ARG 5 2HH1 ARG 5 -13.884 7.762 -15.830
43 1HH2 ARG 5 1HH2 ARG 5 -15.887 5.031 -14.908
44 2HH2 ARG 5 2HH2 ARG 5 -15.568 6.222 -16.136
45 H THR 6 H THR 6 -9.856 4.793 -8.937
46 HA THR 6 HA THR 6 -8.536 6.558 -7.093
47 HB THR 6 HB THR 6 -10.426 5.622 -5.726
48 HG1 THR 6 1HG THR 6 -8.262 6.203 -4.863
49 1HG2 THR 6 1HG2 THR 6 -8.978 3.002 -6.117
50 2HG2 THR 6 2HG2 THR 6 -10.576 3.410 -6.740
51 3HG2 THR 6 3HG2 THR 6 -10.312 3.284 -5.000
52 H SER 7 H SER 7 -8.166 4.849 -9.522
53 HA SER 7 HA SER 7 -6.502 2.653 -8.938
54 1HB SER 7 2HB SER 7 -6.413 4.316 -11.457
55 2HB SER 7 1HB SER 7 -6.085 2.590 -11.279
56 HG SER 7 HG SER 7 -8.169 2.926 -12.130
57 H PHE 8 H PHE 8 -5.945 5.998 -8.792
58 HA PHE 8 HA PHE 8 -3.249 6.184 -9.583
59 1HB PHE 8 2HB PHE 8 -4.503 7.931 -7.473
60 2HB PHE 8 1HB PHE 8 -3.278 8.360 -8.662
61 HD1 PHE 8 1HD PHE 8 -6.795 8.109 -7.945
62 HD2 PHE 8 2HD PHE 8 -3.939 8.623 -11.058
63 HE1 PHE 8 1HE PHE 8 -8.565 8.967 -9.423
64 HE2 PHE 8 2HE PHE 8 -5.704 9.479 -12.540
65 HZ PHE 8 HZ PHE 8 -8.019 9.652 -11.723
66 H VAL 9 H VAL 9 -4.565 6.361 -6.291
67 HA VAL 9 HA VAL 9 -2.070 6.001 -5.023
68 HB VAL 9 HB VAL 9 -4.811 5.495 -3.859
69 1HG1 VAL 9 1HG1 VAL 9 -2.198 6.207 -2.539
70 2HG1 VAL 9 2HG1 VAL 9 -3.017 4.645 -2.469
71 3HG1 VAL 9 3HG1 VAL 9 -3.755 6.062 -1.723
72 1HG2 VAL 9 1HG2 VAL 9 -3.242 8.067 -3.993
73 2HG2 VAL 9 2HG2 VAL 9 -4.748 7.826 -3.107
74 3HG2 VAL 9 3HG2 VAL 9 -4.731 7.701 -4.867
75 H LYS 10 H LYS 10 -4.574 3.804 -6.062
76 HA LYS 10 HA LYS 10 -3.802 1.514 -4.660
77 1HB LYS 10 2HB LYS 10 -5.923 1.734 -5.900
78 2HB LYS 10 1HB LYS 10 -5.033 1.691 -7.415
79 1HG LYS 10 2HG LYS 10 -4.262 -0.572 -6.889
80 2HG LYS 10 1HG LYS 10 -5.184 -0.531 -5.386
81 1HD LYS 10 2HD LYS 10 -7.250 -0.218 -6.692
82 2HD LYS 10 1HD LYS 10 -6.304 -0.313 -8.177
83 1HE LYS 10 2HE LYS 10 -5.611 -2.584 -7.585
84 2HE LYS 10 1HE LYS 10 -6.569 -2.491 -6.107
85 1HZ LYS 10 1HZ LYS 10 -7.604 -2.358 -8.888
86 2HZ LYS 10 2HZ LYS 10 -8.551 -2.178 -7.491
87 3HZ LYS 10 3HZ LYS 10 -7.782 -3.658 -7.810
88 H ARG 11 H ARG 11 -2.724 2.773 -7.811
89 HA ARG 11 HA ARG 11 -1.031 0.521 -8.293
90 1HB ARG 11 2HB ARG 11 -2.007 2.027 -10.088
91 2HB ARG 11 1HB ARG 11 -0.790 3.215 -9.631
92 1HG ARG 11 2HG ARG 11 0.970 1.568 -10.116
93 2HG ARG 11 1HG ARG 11 -0.268 0.424 -10.634
94 1HD ARG 11 2HD ARG 11 -0.973 2.110 -12.347
95 2HD ARG 11 1HD ARG 11 0.441 3.065 -11.896
96 HE ARG 11 HE ARG 11 0.549 0.347 -13.054
97 1HH1 ARG 11 1HH1 ARG 11 1.953 3.517 -12.528
98 2HH1 ARG 11 2HH1 ARG 11 3.358 3.193 -13.501
99 1HH2 ARG 11 1HH2 ARG 11 2.370 -0.055 -14.372
100 2HH2 ARG 11 2HH2 ARG 11 3.576 1.180 -14.583
101 H ILE 12 H ILE 12 -0.660 3.583 -6.669
102 HA ILE 12 HA ILE 12 2.143 3.719 -6.592
103 HB ILE 12 HB ILE 12 0.152 4.619 -4.494
104 1HG1 ILE 12 2HG1 ILE 12 1.551 6.150 -6.704
105 2HG1 ILE 12 1HG1 ILE 12 -0.140 5.665 -6.718
106 1HG2 ILE 12 1HG2 ILE 12 3.051 5.385 -4.837
107 2HG2 ILE 12 2HG2 ILE 12 2.399 4.361 -3.558
108 3HG2 ILE 12 3HG2 ILE 12 1.931 6.058 -3.652
109 1HD1 ILE 12 1HD1 ILE 12 -0.550 7.081 -4.762
110 2HD1 ILE 12 2HD1 ILE 12 0.075 7.999 -6.133
111 3HD1 ILE 12 3HD1 ILE 12 1.140 7.586 -4.788
112 H ALA 13 H ALA 13 -0.165 2.074 -4.459
113 HA ALA 13 HA ALA 13 1.751 0.948 -2.715
114 1HB ALA 13 1HB ALA 13 -0.025 -0.579 -2.038
115 2HB ALA 13 2HB ALA 13 -0.984 -0.103 -3.440
116 3HB ALA 13 3HB ALA 13 -0.634 1.072 -2.171
117 H LYS 14 H LYS 14 0.371 -0.101 -5.765
118 HA LYS 14 HA LYS 14 1.478 -2.670 -5.907
119 1HB LYS 14 2HB LYS 14 -0.271 -2.006 -7.418
120 2HB LYS 14 1HB LYS 14 0.691 -0.677 -8.040
121 1HG LYS 14 2HG LYS 14 1.591 -3.512 -8.392
122 2HG LYS 14 1HG LYS 14 0.398 -2.794 -9.475
123 1HD LYS 14 2HD LYS 14 2.009 -0.956 -9.933
124 2HD LYS 14 1HD LYS 14 3.201 -1.807 -8.953
125 1HE LYS 14 2HE LYS 14 2.860 -3.776 -10.519
126 2HE LYS 14 1HE LYS 14 1.987 -2.656 -11.568
127 1HZ LYS 14 1HZ LYS 14 4.188 -1.253 -11.138
128 2HZ LYS 14 2HZ LYS 14 4.050 -2.365 -12.412
129 3HZ LYS 14 3HZ LYS 14 4.834 -2.819 -10.979
130 H GLU 15 H GLU 15 2.759 0.490 -6.854
131 HA GLU 15 HA GLU 15 5.161 -0.506 -8.007
132 1HB GLU 15 2HB GLU 15 4.482 2.232 -6.922
133 2HB GLU 15 1HB GLU 15 5.912 1.858 -7.873
134 1HG GLU 15 2HG GLU 15 3.145 1.342 -8.907
135 2HG GLU 15 1HG GLU 15 3.924 2.912 -9.069
136 H MET 16 H MET 16 4.203 0.299 -4.756
137 HA MET 16 HA MET 16 6.810 0.445 -3.619
138 1HB MET 16 2HB MET 16 4.809 1.353 -2.509
139 2HB MET 16 1HB MET 16 4.177 -0.278 -2.315
140 1HG MET 16 2HG MET 16 6.125 -0.835 -0.919
141 2HG MET 16 1HG MET 16 6.684 0.829 -1.070
142 1HE MET 16 1HE MET 16 3.751 2.289 -1.017
143 2HE MET 16 2HE MET 16 5.200 2.922 -0.236
144 3HE MET 16 3HE MET 16 3.703 2.748 0.683
145 H ILE 17 H ILE 17 4.364 -2.129 -3.705
146 HA ILE 17 HA ILE 17 6.109 -4.096 -2.532
147 HB ILE 17 HB ILE 17 3.486 -4.617 -3.948
148 1HG1 ILE 17 2HG1 ILE 17 3.933 -3.864 -1.046
149 2HG1 ILE 17 1HG1 ILE 17 3.232 -2.806 -2.269
150 1HG2 ILE 17 1HG2 ILE 17 4.810 -6.600 -3.390
151 2HG2 ILE 17 2HG2 ILE 17 3.346 -6.520 -2.414
152 3HG2 ILE 17 3HG2 ILE 17 4.898 -6.072 -1.709
153 1HD1 ILE 17 1HD1 ILE 17 1.347 -4.318 -2.512
154 2HD1 ILE 17 2HD1 ILE 17 1.533 -3.810 -0.834
155 3HD1 ILE 17 3HD1 ILE 17 2.059 -5.418 -1.335
156 H GLU 18 H GLU 18 6.145 -2.742 -5.482
157 HA GLU 18 HA GLU 18 6.045 -4.819 -7.341
158 1HB GLU 18 2HB GLU 18 5.914 -2.542 -8.067
159 2HB GLU 18 1HB GLU 18 7.486 -2.171 -7.380
160 1HG GLU 18 2HG GLU 18 7.552 -2.335 -9.815
161 2HG GLU 18 1HG GLU 18 8.577 -3.539 -9.040
162 H THR 19 H THR 19 7.293 -6.455 -7.736
163 HA THR 19 HA THR 19 9.142 -7.666 -8.223
164 HB THR 19 HB THR 19 10.660 -5.189 -7.423
165 HG1 THR 19 1HG THR 19 9.212 -5.585 -9.486
166 1HG2 THR 19 1HG2 THR 19 11.673 -7.720 -8.732
167 2HG2 THR 19 2HG2 THR 19 12.070 -7.157 -7.107
168 3HG2 THR 19 3HG2 THR 19 12.598 -6.234 -8.514
169 H HIS 20 H HIS 20 9.679 -5.797 -5.195
170 HA HIS 20 HA HIS 20 10.181 -8.378 -3.904
171 1HB HIS 20 2HB HIS 20 12.381 -7.484 -4.544
172 2HB HIS 20 1HB HIS 20 12.048 -6.015 -3.632
173 HD1 HIS 20 1HD HIS 20 12.411 -9.743 -3.058
174 HD2 HIS 20 2HD HIS 20 12.793 -6.148 -1.000
175 HE1 HIS 20 1HE HIS 20 13.319 -10.351 -0.792
176 HE2 HIS 20 2HE HIS 20 13.306 -8.190 0.508
177 HA PRO 21 HA PRO 21 7.627 -6.168 -0.873
178 1HB PRO 21 2HB PRO 21 6.701 -8.464 0.251
179 2HB PRO 21 1HB PRO 21 5.951 -7.721 -1.165
180 1HG PRO 21 2HG PRO 21 7.828 -10.038 -1.011
181 2HG PRO 21 1HG PRO 21 6.408 -9.812 -2.045
182 1HD PRO 21 2HD PRO 21 8.966 -9.455 -2.914
183 2HD PRO 21 1HD PRO 21 7.576 -8.585 -3.592
184 H GLY 22 H GLY 22 8.283 -5.706 1.191
185 1HA GLY 22 2HA GLY 22 10.809 -6.793 2.047
186 2HA GLY 22 1HA GLY 22 9.891 -5.530 2.850
187 H LYS 23 H LYS 23 9.875 -9.028 2.247
188 HA LYS 23 HA LYS 23 9.269 -10.813 3.506
189 1HB LYS 23 2HB LYS 23 11.000 -9.775 4.998
190 2HB LYS 23 1HB LYS 23 9.707 -8.961 5.860
191 1HG LYS 23 2HG LYS 23 9.635 -11.927 5.610
192 2HG LYS 23 1HG LYS 23 10.748 -11.183 6.756
193 1HD LYS 23 2HD LYS 23 7.794 -10.600 6.678
194 2HD LYS 23 1HD LYS 23 8.512 -11.851 7.689
195 1HE LYS 23 2HE LYS 23 8.224 -9.940 9.060
196 2HE LYS 23 1HE LYS 23 9.947 -10.057 8.711
197 1HZ LYS 23 1HZ LYS 23 8.923 -7.781 8.551
198 2HZ LYS 23 2HZ LYS 23 8.133 -8.316 7.149
199 3HZ LYS 23 3HZ LYS 23 9.825 -8.278 7.206
200 H PHE 24 H PHE 24 7.161 -11.114 2.923
201 HA PHE 24 HA PHE 24 5.174 -9.223 3.836
202 1HB PHE 24 2HB PHE 24 3.631 -10.383 2.291
203 2HB PHE 24 1HB PHE 24 5.090 -9.807 1.503
204 HD1 PHE 24 1HD PHE 24 6.972 -11.553 1.147
205 HD2 PHE 24 2HD PHE 24 2.923 -12.560 2.003
206 HE1 PHE 24 1HE PHE 24 7.330 -13.794 0.206
207 HE2 PHE 24 2HE PHE 24 3.281 -14.807 1.065
208 HZ PHE 24 HZ PHE 24 5.487 -15.424 0.166
209 H THR 25 H THR 25 5.753 -10.202 6.085
210 HA THR 25 HA THR 25 3.852 -12.326 6.717
211 HB THR 25 HB THR 25 5.683 -10.752 8.547
212 HG1 THR 25 1HG THR 25 6.540 -13.131 8.559
213 1HG2 THR 25 1HG2 THR 25 4.014 -13.213 9.088
214 2HG2 THR 25 2HG2 THR 25 3.713 -11.596 9.729
215 3HG2 THR 25 3HG2 THR 25 5.163 -12.480 10.210
216 H ASP 26 H ASP 26 1.838 -11.912 7.438
217 HA ASP 26 HA ASP 26 0.900 -9.236 7.192
218 1HB ASP 26 2HB ASP 26 -1.333 -10.251 7.851
219 2HB ASP 26 1HB ASP 26 -0.590 -10.867 6.382
220 H ASP 27 H ASP 27 2.214 -8.309 8.791
221 HA ASP 27 HA ASP 27 0.723 -8.095 11.307
222 1HB ASP 27 2HB ASP 27 2.847 -9.419 11.671
223 2HB ASP 27 1HB ASP 27 3.749 -8.005 11.138
224 H PHE 28 H PHE 28 0.371 -5.982 11.875
225 HA PHE 28 HA PHE 28 0.528 -4.115 9.789
226 1HB PHE 28 2HB PHE 28 -0.232 -3.850 12.683
227 2HB PHE 28 1HB PHE 28 -0.232 -2.467 11.594
228 HD1 PHE 28 1HD PHE 28 -1.797 -5.717 12.316
229 HD2 PHE 28 2HD PHE 28 -1.900 -2.206 9.916
230 HE1 PHE 28 1HE PHE 28 -4.045 -6.331 11.517
231 HE2 PHE 28 2HE PHE 28 -4.145 -2.809 9.118
232 HZ PHE 28 HZ PHE 28 -5.221 -4.874 9.918
233 H ASP 29 H ASP 29 2.804 -4.886 12.219
234 HA ASP 29 HA ASP 29 4.177 -2.424 12.408
235 1HB ASP 29 2HB ASP 29 4.449 -4.568 13.830
236 2HB ASP 29 1HB ASP 29 5.521 -5.117 12.548
237 H THR 30 H THR 30 4.504 -5.205 10.258
238 HA THR 30 HA THR 30 6.835 -4.329 8.946
239 HB THR 30 HB THR 30 4.713 -6.280 8.030
240 HG1 THR 30 1HG THR 30 5.682 -7.585 9.388
241 1HG2 THR 30 1HG2 THR 30 6.032 -5.479 6.128
242 2HG2 THR 30 2HG2 THR 30 6.437 -7.153 6.510
243 3HG2 THR 30 3HG2 THR 30 7.521 -5.851 6.996
244 H ASN 31 H ASN 31 3.411 -4.251 7.872
245 HA ASN 31 HA ASN 31 4.016 -3.133 5.370
246 1HB ASN 31 2HB ASN 31 1.554 -2.544 5.298
247 2HB ASN 31 1HB ASN 31 1.940 -4.241 5.552
248 1HD2 ASN 31 1HD2 ASN 31 0.554 -1.392 6.908
249 2HD2 ASN 31 2HD2 ASN 31 -0.079 -2.132 8.332
250 H LYS 32 H LYS 32 3.070 -1.526 8.423
251 HA LYS 32 HA LYS 32 2.907 1.030 7.166
252 1HB LYS 32 2HB LYS 32 2.014 1.675 9.109
253 2HB LYS 32 1HB LYS 32 2.206 0.024 9.663
254 1HG LYS 32 2HG LYS 32 4.503 1.881 9.966
255 2HG LYS 32 1HG LYS 32 3.116 2.072 11.039
256 1HD LYS 32 2HD LYS 32 3.332 -0.255 11.738
257 2HD LYS 32 1HD LYS 32 4.690 -0.470 10.635
258 1HE LYS 32 2HE LYS 32 5.993 1.145 11.864
259 2HE LYS 32 1HE LYS 32 4.625 1.501 12.914
260 1HZ LYS 32 1HZ LYS 32 6.227 0.008 13.961
261 2HZ LYS 32 2HZ LYS 32 6.007 -1.125 12.723
262 3HZ LYS 32 3HZ LYS 32 4.719 -0.749 13.763
263 H LYS 33 H LYS 33 5.468 -0.809 8.601
264 HA LYS 33 HA LYS 33 7.333 1.348 8.787
265 1HB LYS 33 2HB LYS 33 7.417 -0.694 10.185
266 2HB LYS 33 1HB LYS 33 7.802 -1.635 8.755
267 1HG LYS 33 2HG LYS 33 9.925 -0.615 8.542
268 2HG LYS 33 1HG LYS 33 9.522 0.628 9.730
269 1HD LYS 33 2HD LYS 33 9.681 -2.321 10.338
270 2HD LYS 33 1HD LYS 33 10.992 -1.174 10.620
271 1HE LYS 33 2HE LYS 33 9.695 0.036 12.208
272 2HE LYS 33 1HE LYS 33 8.238 -0.861 11.789
273 1HZ LYS 33 1HZ LYS 33 9.418 -1.521 13.899
274 2HZ LYS 33 2HZ LYS 33 10.624 -2.197 12.916
275 3HZ LYS 33 3HZ LYS 33 9.035 -2.772 12.831
276 H LEU 34 H LEU 34 6.420 -0.969 6.337
277 HA LEU 34 HA LEU 34 8.623 -0.553 4.606
278 1HB LEU 34 2HB LEU 34 5.790 -1.388 3.985
279 2HB LEU 34 1HB LEU 34 7.113 -1.439 2.839
280 HG LEU 34 HG LEU 34 6.894 -3.060 5.376
281 1HD1 LEU 34 1HD1 LEU 34 6.750 -4.968 3.852
282 2HD1 LEU 34 2HD1 LEU 34 6.758 -3.865 2.475
283 3HD1 LEU 34 3HD1 LEU 34 5.413 -3.841 3.618
284 1HD2 LEU 34 1HD2 LEU 34 9.207 -2.479 4.958
285 2HD2 LEU 34 2HD2 LEU 34 9.061 -3.002 3.280
286 3HD2 LEU 34 3HD2 LEU 34 8.937 -4.182 4.586
287 H VAL 35 H VAL 35 5.369 0.888 4.713
288 HA VAL 35 HA VAL 35 5.753 2.682 2.572
289 HB VAL 35 HB VAL 35 3.953 3.201 4.941
290 1HG1 VAL 35 1HG1 VAL 35 4.175 5.056 3.386
291 2HG1 VAL 35 2HG1 VAL 35 2.562 4.351 3.278
292 3HG1 VAL 35 3HG1 VAL 35 3.765 3.996 2.037
293 1HG2 VAL 35 1HG2 VAL 35 3.421 1.468 2.531
294 2HG2 VAL 35 2HG2 VAL 35 2.201 1.986 3.693
295 3HG2 VAL 35 3HG2 VAL 35 3.523 0.939 4.211
296 H GLU 36 H GLU 36 6.708 2.765 5.898
297 HA GLU 36 HA GLU 36 7.176 5.521 6.202
298 1HB GLU 36 2HB GLU 36 7.108 3.989 8.107
299 2HB GLU 36 1HB GLU 36 8.557 3.178 7.525
300 1HG GLU 36 2HG GLU 36 9.744 5.381 7.746
301 2HG GLU 36 1HG GLU 36 8.312 5.977 8.580
302 H GLU 37 H GLU 37 8.808 3.244 4.238
303 HA GLU 37 HA GLU 37 10.937 5.122 3.709
304 1HB GLU 37 2HB GLU 37 11.567 3.781 5.793
305 2HB GLU 37 1HB GLU 37 11.713 2.396 4.726
306 1HG GLU 37 2HG GLU 37 13.486 3.442 3.507
307 2HG GLU 37 1HG GLU 37 13.259 4.953 4.389
308 H PHE 38 H PHE 38 9.086 4.381 1.979
309 HA PHE 38 HA PHE 38 10.742 3.168 -0.067
310 1HB PHE 38 2HB PHE 38 8.133 1.995 0.810
311 2HB PHE 38 1HB PHE 38 8.531 1.976 -0.905
312 HD1 PHE 38 1HD PHE 38 11.166 1.247 -1.238
313 HD2 PHE 38 2HD PHE 38 8.554 0.021 1.892
314 HE1 PHE 38 1HE PHE 38 12.522 -0.781 -0.905
315 HE2 PHE 38 2HE PHE 38 9.908 -2.005 2.232
316 HZ PHE 38 HZ PHE 38 11.892 -2.410 0.836
317 H SER 39 H SER 39 7.276 3.633 -0.372
318 HA SER 39 HA SER 39 7.707 5.854 -2.187
319 1HB SER 39 2HB SER 39 5.069 4.697 -1.265
320 2HB SER 39 1HB SER 39 5.385 5.628 -2.731
321 HG SER 39 HG SER 39 6.792 3.857 -3.370
322 H THR 40 H THR 40 8.663 6.862 -0.037
323 HA THR 40 HA THR 40 6.586 8.033 1.638
324 HB THR 40 HB THR 40 9.571 8.351 1.961
325 HG1 THR 40 1HG THR 40 7.895 6.349 3.118
326 1HG2 THR 40 1HG2 THR 40 8.191 9.882 3.269
327 2HG2 THR 40 2HG2 THR 40 8.969 8.702 4.322
328 3HG2 THR 40 3HG2 THR 40 7.263 8.527 3.907
329 H VAL 41 H VAL 41 5.717 9.492 0.141
330 HA VAL 41 HA VAL 41 7.059 12.030 0.087
331 HB VAL 41 HB VAL 41 8.051 11.191 -1.919
332 1HG1 VAL 41 1HG1 VAL 41 6.764 10.303 -3.800
333 2HG1 VAL 41 2HG1 VAL 41 5.291 10.393 -2.833
334 3HG1 VAL 41 3HG1 VAL 41 6.592 9.300 -2.360
335 1HG2 VAL 41 1HG2 VAL 41 7.180 12.719 -3.605
336 2HG2 VAL 41 2HG2 VAL 41 7.234 13.493 -2.021
337 3HG2 VAL 41 3HG2 VAL 41 5.698 12.921 -2.672
338 H SER 42 H SER 42 5.514 13.246 0.885
339 HA SER 42 HA SER 42 3.528 14.250 1.270
340 1HB SER 42 2HB SER 42 2.728 13.128 -1.425
341 2HB SER 42 1HB SER 42 1.904 14.422 -0.555
342 HG SER 42 HG SER 42 4.563 14.929 -0.803
343 H THR 43 H THR 43 3.958 11.068 1.349
344 HA THR 43 HA THR 43 1.198 10.236 1.661
345 HB THR 43 HB THR 43 2.402 7.991 2.196
346 HG1 THR 43 1HG THR 43 4.511 7.998 1.068
347 1HG2 THR 43 1HG2 THR 43 1.174 8.418 0.133
348 2HG2 THR 43 2HG2 THR 43 2.658 7.526 -0.206
349 3HG2 THR 43 3HG2 THR 43 2.571 9.256 -0.543
350 H LYS 44 H LYS 44 1.727 12.099 3.510
351 HA LYS 44 HA LYS 44 2.819 11.253 5.954
352 1HB LYS 44 2HB LYS 44 0.656 13.298 5.422
353 2HB LYS 44 1HB LYS 44 1.541 13.134 6.934
354 1HG LYS 44 2HG LYS 44 3.577 13.791 5.913
355 2HG LYS 44 1HG LYS 44 2.873 13.684 4.299
356 1HD LYS 44 2HD LYS 44 1.352 15.533 4.858
357 2HD LYS 44 1HD LYS 44 2.095 15.648 6.455
358 1HE LYS 44 2HE LYS 44 4.211 16.247 5.485
359 2HE LYS 44 1HE LYS 44 3.589 15.967 3.860
360 1HZ LYS 44 1HZ LYS 44 2.633 18.064 5.735
361 2HZ LYS 44 2HZ LYS 44 2.046 17.796 4.170
362 3HZ LYS 44 3HZ LYS 44 3.644 18.318 4.396
363 H HIS 45 H HIS 45 -0.664 11.903 5.569
364 HA HIS 45 HA HIS 45 -1.264 9.770 7.440
365 1HB HIS 45 2HB HIS 45 -2.980 11.800 6.014
366 2HB HIS 45 1HB HIS 45 -3.675 10.498 6.973
367 HD1 HIS 45 1HD HIS 45 -3.685 13.718 7.519
368 HD2 HIS 45 2HD HIS 45 -1.528 10.770 9.512
369 HE1 HIS 45 1HE HIS 45 -3.158 14.673 9.787
370 HE2 HIS 45 2HE HIS 45 -2.009 12.806 11.035
371 H LEU 46 H LEU 46 -0.921 10.129 4.106
372 HA LEU 46 HA LEU 46 -2.708 8.122 3.214
373 1HB LEU 46 2HB LEU 46 -0.160 9.202 2.007
374 2HB LEU 46 1HB LEU 46 -1.172 8.020 1.206
375 HG LEU 46 HG LEU 46 -1.698 10.109 0.245
376 1HD1 LEU 46 1HD1 LEU 46 -3.843 9.498 2.270
377 2HD1 LEU 46 2HD1 LEU 46 -3.631 8.704 0.710
378 3HD1 LEU 46 3HD1 LEU 46 -4.045 10.416 0.778
379 1HD2 LEU 46 1HD2 LEU 46 -2.054 11.198 3.034
380 2HD2 LEU 46 2HD2 LEU 46 -2.378 12.073 1.538
381 3HD2 LEU 46 3HD2 LEU 46 -0.734 11.570 1.924
382 H ARG 47 H ARG 47 0.455 8.092 4.644
383 HA ARG 47 HA ARG 47 1.338 5.533 4.021
384 1HB ARG 47 2HB ARG 47 2.743 7.151 5.182
385 2HB ARG 47 1HB ARG 47 1.678 7.115 6.581
386 1HG ARG 47 2HG ARG 47 2.301 4.852 7.071
387 2HG ARG 47 1HG ARG 47 3.235 4.743 5.578
388 1HD ARG 47 2HD ARG 47 4.712 5.083 7.467
389 2HD ARG 47 1HD ARG 47 4.742 6.492 6.409
390 HE ARG 47 HE ARG 47 2.870 7.123 8.285
391 1HH1 ARG 47 1HH1 ARG 47 6.211 6.099 8.425
392 2HH1 ARG 47 2HH1 ARG 47 6.558 6.964 9.889
393 1HH2 ARG 47 1HH2 ARG 47 3.298 8.244 10.218
394 2HH2 ARG 47 2HH2 ARG 47 4.886 8.164 10.933
395 H ASN 48 H ASN 48 -1.035 6.614 6.358
396 HA ASN 48 HA ASN 48 -1.277 4.196 7.804
397 1HB ASN 48 2HB ASN 48 -2.132 6.409 8.582
398 2HB ASN 48 1HB ASN 48 -3.388 6.320 7.353
399 1HD2 ASN 48 1HD2 ASN 48 -2.173 3.666 9.316
400 2HD2 ASN 48 2HD2 ASN 48 -3.649 3.380 10.166
401 H LYS 49 H LYS 49 -2.999 5.523 5.012
402 HA LYS 49 HA LYS 49 -4.856 3.360 4.848
403 1HB LYS 49 2HB LYS 49 -4.173 5.566 2.902
404 2HB LYS 49 1HB LYS 49 -5.490 4.418 2.677
405 1HG LYS 49 2HG LYS 49 -6.556 5.210 4.707
406 2HG LYS 49 1HG LYS 49 -5.221 6.326 4.989
407 1HD LYS 49 2HD LYS 49 -5.774 7.580 3.021
408 2HD LYS 49 1HD LYS 49 -6.984 6.386 2.545
409 1HE LYS 49 2HE LYS 49 -8.314 6.919 4.510
410 2HE LYS 49 1HE LYS 49 -7.086 8.062 5.052
411 1HZ LYS 49 1HZ LYS 49 -7.566 9.507 3.285
412 2HZ LYS 49 2HZ LYS 49 -9.083 9.015 3.866
413 3HZ LYS 49 3HZ LYS 49 -8.461 8.338 2.442
414 H ILE 50 H ILE 50 -1.954 4.284 3.011
415 HA ILE 50 HA ILE 50 -2.086 2.206 1.116
416 HB ILE 50 HB ILE 50 0.353 3.652 2.170
417 1HG1 ILE 50 2HG1 ILE 50 -1.307 4.098 -0.324
418 2HG1 ILE 50 1HG1 ILE 50 -1.351 5.106 1.120
419 1HG2 ILE 50 1HG2 ILE 50 0.995 1.550 1.132
420 2HG2 ILE 50 2HG2 ILE 50 1.452 2.903 0.097
421 3HG2 ILE 50 3HG2 ILE 50 0.030 1.937 -0.291
422 1HD1 ILE 50 1HD1 ILE 50 1.047 4.693 -0.650
423 2HD1 ILE 50 2HD1 ILE 50 0.959 5.748 0.762
424 3HD1 ILE 50 3HD1 ILE 50 -0.017 6.099 -0.664
425 H ALA 51 H ALA 51 -0.529 2.389 4.294
426 HA ALA 51 HA ALA 51 0.682 -0.137 4.290
427 1HB ALA 51 1HB ALA 51 0.711 0.049 6.714
428 2HB ALA 51 2HB ALA 51 -0.476 1.350 6.646
429 3HB ALA 51 3HB ALA 51 1.137 1.593 5.976
430 H GLY 52 H GLY 52 -2.573 0.899 5.219
431 1HA GLY 52 2HA GLY 52 -3.548 -1.571 6.127
432 2HA GLY 52 1HA GLY 52 -4.529 -0.274 5.457
433 H TYR 53 H TYR 53 -3.530 -0.153 2.876
434 HA TYR 53 HA TYR 53 -4.885 -2.198 1.542
435 1HB TYR 53 2HB TYR 53 -2.872 -0.154 0.684
436 2HB TYR 53 1HB TYR 53 -3.326 -1.433 -0.435
437 HD1 TYR 53 1HD TYR 53 -5.784 -1.693 -1.023
438 HD2 TYR 53 2HD TYR 53 -4.241 1.741 0.959
439 HE1 TYR 53 1HE TYR 53 -7.769 -0.415 -1.703
440 HE2 TYR 53 2HE TYR 53 -6.227 3.027 0.285
441 HH TYR 53 HH TYR 53 -7.955 2.966 -1.445
442 H ILE 54 H ILE 54 -1.438 -1.860 2.305
443 HA ILE 54 HA ILE 54 -0.475 -4.056 0.892
444 HB ILE 54 HB ILE 54 0.516 -3.014 3.553
445 1HG1 ILE 54 2HG1 ILE 54 1.363 -2.355 0.721
446 2HG1 ILE 54 1HG1 ILE 54 0.464 -1.292 1.801
447 1HG2 ILE 54 1HG2 ILE 54 1.912 -4.714 1.490
448 2HG2 ILE 54 2HG2 ILE 54 1.368 -5.250 3.080
449 3HG2 ILE 54 3HG2 ILE 54 2.650 -4.047 2.945
450 1HD1 ILE 54 1HD1 ILE 54 2.384 -1.261 3.329
451 2HD1 ILE 54 2HD1 ILE 54 2.786 -0.648 1.725
452 3HD1 ILE 54 3HD1 ILE 54 3.281 -2.274 2.198
453 H THR 55 H THR 55 -1.483 -3.954 4.333
454 HA THR 55 HA THR 55 -1.260 -6.673 4.860
455 HB THR 55 HB THR 55 -3.469 -5.909 6.337
456 HG1 THR 55 1HG THR 55 -3.281 -3.777 5.464
457 1HG2 THR 55 1HG2 THR 55 -0.540 -5.516 6.961
458 2HG2 THR 55 2HG2 THR 55 -1.470 -6.993 7.212
459 3HG2 THR 55 3HG2 THR 55 -1.841 -5.547 8.150
460 H ARG 56 H ARG 56 -3.958 -4.885 3.414
461 HA ARG 56 HA ARG 56 -5.767 -7.059 3.393
462 1HB ARG 56 2HB ARG 56 -5.661 -4.582 1.668
463 2HB ARG 56 1HB ARG 56 -6.977 -5.747 1.634
464 1HG ARG 56 2HG ARG 56 -7.254 -5.301 4.108
465 2HG ARG 56 1HG ARG 56 -6.172 -3.926 3.878
466 1HD ARG 56 2HD ARG 56 -8.449 -3.161 3.732
467 2HD ARG 56 1HD ARG 56 -7.709 -3.067 2.134
468 HE ARG 56 HE ARG 56 -8.878 -5.430 1.944
469 1HH1 ARG 56 1HH1 ARG 56 -10.126 -2.419 3.244
470 2HH1 ARG 56 2HH1 ARG 56 -11.787 -2.833 2.945
471 1HH2 ARG 56 1HH2 ARG 56 -11.071 -5.969 1.552
472 2HH2 ARG 56 2HH2 ARG 56 -12.323 -4.857 2.012
473 H ILE 57 H ILE 57 -3.441 -5.860 1.011
474 HA ILE 57 HA ILE 57 -4.131 -7.668 -1.054
475 HB ILE 57 HB ILE 57 -1.518 -6.240 -0.530
476 1HG1 ILE 57 2HG1 ILE 57 -3.807 -5.608 -2.411
477 2HG1 ILE 57 1HG1 ILE 57 -3.457 -4.764 -0.903
478 1HG2 ILE 57 1HG2 ILE 57 -2.456 -7.671 -3.015
479 2HG2 ILE 57 2HG2 ILE 57 -1.158 -8.198 -1.944
480 3HG2 ILE 57 3HG2 ILE 57 -0.982 -6.713 -2.880
481 1HD1 ILE 57 1HD1 ILE 57 -1.707 -4.843 -3.351
482 2HD1 ILE 57 2HD1 ILE 57 -1.313 -4.030 -1.836
483 3HD1 ILE 57 3HD1 ILE 57 -2.686 -3.485 -2.798
484 H ILE 58 H ILE 58 -1.629 -7.786 1.475
485 HA ILE 58 HA ILE 58 -0.475 -10.235 0.772
486 HB ILE 58 HB ILE 58 -0.812 -9.035 3.531
487 1HG1 ILE 58 2HG1 ILE 58 1.551 -9.003 1.637
488 2HG1 ILE 58 1HG1 ILE 58 0.451 -7.652 1.901
489 1HG2 ILE 58 1HG2 ILE 58 1.014 -11.254 2.613
490 2HG2 ILE 58 2HG2 ILE 58 -0.368 -11.423 3.695
491 3HG2 ILE 58 3HG2 ILE 58 1.042 -10.496 4.204
492 1HD1 ILE 58 1HD1 ILE 58 1.144 -7.580 4.257
493 2HD1 ILE 58 2HD1 ILE 58 2.492 -7.335 3.147
494 3HD1 ILE 58 3HD1 ILE 58 2.282 -8.893 3.945
495 H SER 59 H SER 59 -3.132 -9.565 3.041
496 HA SER 59 HA SER 59 -3.649 -12.259 3.692
497 1HB SER 59 2HB SER 59 -4.413 -10.344 5.051
498 2HB SER 59 1HB SER 59 -5.532 -9.890 3.770
499 HG SER 59 HG SER 59 -5.665 -12.514 4.734
500 H GLN 60 H GLN 60 -4.655 -10.245 1.031
501 HA GLN 60 HA GLN 60 -6.823 -11.853 0.143
502 1HB GLN 60 2HB GLN 60 -6.374 -9.427 -0.450
503 2HB GLN 60 1HB GLN 60 -5.121 -10.005 -1.536
504 1HG GLN 60 2HG GLN 60 -7.148 -9.527 -2.750
505 2HG GLN 60 1HG GLN 60 -6.802 -11.256 -2.795
506 1HE2 GLN 60 1HE2 GLN 60 -8.867 -8.779 -1.471
507 2HE2 GLN 60 2HE2 GLN 60 -10.137 -9.837 -0.965
508 H GLN 61 H GLN 61 -3.376 -11.920 -0.301
509 HA GLN 61 HA GLN 61 -3.492 -13.817 -2.476
510 1HB GLN 61 2HB GLN 61 -1.159 -12.749 -0.884
511 2HB GLN 61 1HB GLN 61 -1.010 -13.860 -2.238
512 1HG GLN 61 2HG GLN 61 -2.311 -11.162 -2.470
513 2HG GLN 61 1HG GLN 61 -0.590 -11.427 -2.727
514 1HE2 GLN 61 1HE2 GLN 61 -3.073 -13.728 -3.694
515 2HE2 GLN 61 2HE2 GLN 61 -2.861 -13.509 -5.393
516 H LYS 62 H LYS 62 -3.046 -13.887 1.006
517 HA LYS 62 HA LYS 62 -2.612 -16.785 0.836
518 1HB LYS 62 2HB LYS 62 -1.978 -16.626 3.249
519 2HB LYS 62 1HB LYS 62 -0.916 -15.745 2.162
520 1HG LYS 62 2HG LYS 62 -1.816 -13.659 2.836
521 2HG LYS 62 1HG LYS 62 -3.150 -14.434 3.692
522 1HD LYS 62 2HD LYS 62 -1.519 -13.694 5.296
523 2HD LYS 62 1HD LYS 62 -1.505 -15.457 5.235
524 1HE LYS 62 2HE LYS 62 0.446 -15.303 3.677
525 2HE LYS 62 1HE LYS 62 0.476 -13.566 3.983
526 1HZ LYS 62 1HZ LYS 62 0.682 -14.150 6.403
527 2HZ LYS 62 2HZ LYS 62 2.027 -14.547 5.448
528 3HZ LYS 62 3HZ LYS 62 0.945 -15.757 5.921
Start of MODEL 6
1 1H MET 1 1HT MET 1 -17.417 10.373 -16.031
2 2H MET 1 2HT MET 1 -18.487 11.685 -15.924
3 3H MET 1 3HT MET 1 -19.054 10.170 -16.433
4 HA MET 1 HA MET 1 -19.726 10.553 -14.181
5 1HB MET 1 2HB MET 1 -17.486 8.533 -14.452
6 2HB MET 1 1HB MET 1 -18.602 8.592 -13.097
7 1HG MET 1 2HG MET 1 -19.364 8.123 -15.969
8 2HG MET 1 1HG MET 1 -19.200 6.877 -14.733
9 1HE MET 1 1HE MET 1 -23.061 6.946 -15.235
10 2HE MET 1 2HE MET 1 -21.619 5.936 -15.119
11 3HE MET 1 3HE MET 1 -21.792 7.077 -16.452
12 H GLY 2 H GLY 2 -19.325 11.350 -12.163
13 1HA GLY 2 2HA GLY 2 -16.920 12.867 -11.730
14 2HA GLY 2 1HA GLY 2 -18.228 12.631 -10.576
15 H ASN 3 H ASN 3 -15.231 11.381 -11.814
16 HA ASN 3 HA ASN 3 -15.326 9.157 -9.919
17 1HB ASN 3 2HB ASN 3 -13.245 8.409 -11.239
18 2HB ASN 3 1HB ASN 3 -14.813 8.298 -12.024
19 1HD2 ASN 3 1HD2 ASN 3 -13.849 8.304 -14.053
20 2HD2 ASN 3 2HD2 ASN 3 -13.197 9.742 -14.753
21 H ILE 4 H ILE 4 -14.444 9.452 -8.011
22 HA ILE 4 HA ILE 4 -12.207 11.236 -7.607
23 HB ILE 4 HB ILE 4 -13.881 10.861 -5.816
24 1HG1 ILE 4 2HG1 ILE 4 -11.095 9.942 -5.061
25 2HG1 ILE 4 1HG1 ILE 4 -11.584 11.619 -5.271
26 1HG2 ILE 4 1HG2 ILE 4 -12.707 8.086 -5.660
27 2HG2 ILE 4 2HG2 ILE 4 -14.330 8.496 -6.216
28 3HG2 ILE 4 3HG2 ILE 4 -13.876 8.782 -4.536
29 1HD1 ILE 4 1HD1 ILE 4 -12.593 9.703 -3.183
30 2HD1 ILE 4 2HD1 ILE 4 -13.183 11.349 -3.413
31 3HD1 ILE 4 3HD1 ILE 4 -11.509 11.072 -2.929
32 H ARG 5 H ARG 5 -12.799 7.889 -8.234
33 HA ARG 5 HA ARG 5 -11.480 6.206 -8.916
34 1HB ARG 5 2HB ARG 5 -9.612 8.521 -9.348
35 2HB ARG 5 1HB ARG 5 -9.106 6.867 -9.681
36 1HG ARG 5 2HG ARG 5 -10.398 6.690 -11.513
37 2HG ARG 5 1HG ARG 5 -11.692 7.673 -10.828
38 1HD ARG 5 2HD ARG 5 -10.611 8.737 -12.767
39 2HD ARG 5 1HD ARG 5 -10.468 9.692 -11.295
40 HE ARG 5 HE ARG 5 -8.170 9.224 -11.227
41 1HH1 ARG 5 1HH1 ARG 5 -9.706 7.613 -13.925
42 2HH1 ARG 5 2HH1 ARG 5 -8.257 7.547 -14.882
43 1HH2 ARG 5 1HH2 ARG 5 -6.248 9.108 -12.471
44 2HH2 ARG 5 2HH2 ARG 5 -6.281 8.344 -14.031
45 H THR 6 H THR 6 -9.080 5.326 -8.540
46 HA THR 6 HA THR 6 -8.036 5.702 -5.886
47 HB THR 6 HB THR 6 -9.245 2.983 -6.506
48 HG1 THR 6 1HG THR 6 -10.466 5.256 -5.562
49 1HG2 THR 6 1HG2 THR 6 -8.928 2.574 -4.123
50 2HG2 THR 6 2HG2 THR 6 -8.279 4.200 -3.918
51 3HG2 THR 6 3HG2 THR 6 -7.398 3.015 -4.881
52 H SER 7 H SER 7 -7.437 5.656 -8.799
53 HA SER 7 HA SER 7 -6.014 3.315 -9.493
54 1HB SER 7 2HB SER 7 -5.568 6.018 -10.733
55 2HB SER 7 1HB SER 7 -5.561 4.432 -11.507
56 HG SER 7 HG SER 7 -7.636 4.618 -11.822
57 H PHE 8 H PHE 8 -5.096 6.388 -8.043
58 HA PHE 8 HA PHE 8 -2.301 6.112 -8.324
59 1HB PHE 8 2HB PHE 8 -3.971 7.679 -6.361
60 2HB PHE 8 1HB PHE 8 -2.213 7.748 -6.388
61 HD1 PHE 8 1HD PHE 8 -5.258 8.969 -7.836
62 HD2 PHE 8 2HD PHE 8 -1.070 8.552 -8.483
63 HE1 PHE 8 1HE PHE 8 -5.354 10.720 -9.554
64 HE2 PHE 8 2HE PHE 8 -1.162 10.308 -10.207
65 HZ PHE 8 HZ PHE 8 -3.305 11.394 -10.743
66 H VAL 9 H VAL 9 -4.557 5.025 -5.849
67 HA VAL 9 HA VAL 9 -2.657 4.290 -3.909
68 HB VAL 9 HB VAL 9 -5.381 3.063 -4.370
69 1HG1 VAL 9 1HG1 VAL 9 -5.283 2.497 -1.992
70 2HG1 VAL 9 2HG1 VAL 9 -3.654 3.165 -1.899
71 3HG1 VAL 9 3HG1 VAL 9 -3.966 1.735 -2.884
72 1HG2 VAL 9 1HG2 VAL 9 -4.586 5.404 -2.641
73 2HG2 VAL 9 2HG2 VAL 9 -6.192 4.682 -2.735
74 3HG2 VAL 9 3HG2 VAL 9 -5.510 5.496 -4.142
75 H LYS 10 H LYS 10 -4.331 2.322 -6.359
76 HA LYS 10 HA LYS 10 -2.962 -0.076 -5.859
77 1HB LYS 10 2HB LYS 10 -5.018 0.033 -7.195
78 2HB LYS 10 1HB LYS 10 -4.173 0.945 -8.438
79 1HG LYS 10 2HG LYS 10 -2.671 -1.013 -8.762
80 2HG LYS 10 1HG LYS 10 -3.700 -1.918 -7.648
81 1HD LYS 10 2HD LYS 10 -4.626 -0.615 -10.208
82 2HD LYS 10 1HD LYS 10 -4.265 -2.332 -10.017
83 1HE LYS 10 2HE LYS 10 -6.048 -2.576 -8.413
84 2HE LYS 10 1HE LYS 10 -6.347 -0.838 -8.427
85 1HZ LYS 10 1HZ LYS 10 -6.643 -2.594 -10.803
86 2HZ LYS 10 2HZ LYS 10 -7.094 -0.963 -10.676
87 3HZ LYS 10 3HZ LYS 10 -7.927 -2.147 -9.787
88 H ARG 11 H ARG 11 -2.286 2.609 -8.033
89 HA ARG 11 HA ARG 11 -0.113 1.546 -9.418
90 1HB ARG 11 2HB ARG 11 -1.190 3.520 -10.198
91 2HB ARG 11 1HB ARG 11 -0.878 4.366 -8.690
92 1HG ARG 11 2HG ARG 11 1.508 4.393 -9.195
93 2HG ARG 11 1HG ARG 11 1.195 3.532 -10.708
94 1HD ARG 11 2HD ARG 11 -0.016 5.344 -11.603
95 2HD ARG 11 1HD ARG 11 -0.130 6.144 -10.038
96 HE ARG 11 HE ARG 11 2.481 6.178 -10.362
97 1HH1 ARG 11 1HH1 ARG 11 -0.025 6.768 -12.732
98 2HH1 ARG 11 2HH1 ARG 11 0.894 7.955 -13.613
99 1HH2 ARG 11 1HH2 ARG 11 3.695 7.758 -11.510
100 2HH2 ARG 11 2HH2 ARG 11 3.020 8.483 -12.936
101 H ILE 12 H ILE 12 -0.078 3.692 -6.562
102 HA ILE 12 HA ILE 12 2.712 3.657 -6.206
103 HB ILE 12 HB ILE 12 0.526 4.143 -4.176
104 1HG1 ILE 12 2HG1 ILE 12 2.256 6.083 -5.728
105 2HG1 ILE 12 1HG1 ILE 12 0.579 5.707 -6.108
106 1HG2 ILE 12 1HG2 ILE 12 2.585 3.525 -3.049
107 2HG2 ILE 12 2HG2 ILE 12 2.262 5.245 -2.829
108 3HG2 ILE 12 3HG2 ILE 12 3.482 4.718 -3.990
109 1HD1 ILE 12 1HD1 ILE 12 0.789 7.817 -4.909
110 2HD1 ILE 12 2HD1 ILE 12 1.553 6.976 -3.560
111 3HD1 ILE 12 3HD1 ILE 12 -0.124 6.633 -3.975
112 H ALA 13 H ALA 13 0.145 1.637 -4.820
113 HA ALA 13 HA ALA 13 1.740 0.162 -3.048
114 1HB ALA 13 1HB ALA 13 -0.748 -0.755 -4.485
115 2HB ALA 13 2HB ALA 13 -0.712 0.167 -2.981
116 3HB ALA 13 3HB ALA 13 -0.059 -1.471 -3.029
117 H LYS 14 H LYS 14 0.912 -0.399 -6.446
118 HA LYS 14 HA LYS 14 2.077 -2.923 -6.750
119 1HB LYS 14 2HB LYS 14 0.591 -1.686 -8.390
120 2HB LYS 14 1HB LYS 14 2.011 -0.765 -8.863
121 1HG LYS 14 2HG LYS 14 3.123 -2.897 -9.479
122 2HG LYS 14 1HG LYS 14 1.609 -3.735 -9.136
123 1HD LYS 14 2HD LYS 14 1.592 -3.378 -11.460
124 2HD LYS 14 1HD LYS 14 0.539 -2.122 -10.804
125 1HE LYS 14 2HE LYS 14 1.927 -1.073 -12.423
126 2HE LYS 14 1HE LYS 14 2.532 -0.585 -10.841
127 1HZ LYS 14 1HZ LYS 14 4.217 -2.374 -11.044
128 2HZ LYS 14 2HZ LYS 14 4.378 -1.166 -12.219
129 3HZ LYS 14 3HZ LYS 14 3.686 -2.655 -12.627
130 H GLU 15 H GLU 15 3.453 0.302 -7.281
131 HA GLU 15 HA GLU 15 6.029 -0.639 -8.025
132 1HB GLU 15 2HB GLU 15 5.056 2.061 -7.086
133 2HB GLU 15 1HB GLU 15 6.696 1.758 -7.644
134 1HG GLU 15 2HG GLU 15 5.912 1.187 -9.831
135 2HG GLU 15 1HG GLU 15 4.234 1.257 -9.299
136 H MET 16 H MET 16 4.511 0.047 -4.969
137 HA MET 16 HA MET 16 6.910 0.096 -3.424
138 1HB MET 16 2HB MET 16 4.766 1.030 -2.620
139 2HB MET 16 1HB MET 16 4.103 -0.597 -2.550
140 1HG MET 16 2HG MET 16 5.816 -1.201 -0.894
141 2HG MET 16 1HG MET 16 6.410 0.457 -0.932
142 1HE MET 16 1HE MET 16 3.278 2.415 0.434
143 2HE MET 16 2HE MET 16 3.626 2.032 -1.253
144 3HE MET 16 3HE MET 16 4.925 2.564 -0.184
145 H ILE 17 H ILE 17 4.595 -2.422 -4.323
146 HA ILE 17 HA ILE 17 5.795 -4.519 -2.839
147 HB ILE 17 HB ILE 17 4.178 -4.715 -5.394
148 1HG1 ILE 17 2HG1 ILE 17 2.935 -3.588 -3.606
149 2HG1 ILE 17 1HG1 ILE 17 2.269 -5.187 -3.917
150 1HG2 ILE 17 1HG2 ILE 17 4.829 -6.813 -3.326
151 2HG2 ILE 17 2HG2 ILE 17 5.441 -6.745 -4.980
152 3HG2 ILE 17 3HG2 ILE 17 3.725 -7.024 -4.687
153 1HD1 ILE 17 1HD1 ILE 17 4.098 -4.447 -1.649
154 2HD1 ILE 17 2HD1 ILE 17 3.428 -6.050 -1.954
155 3HD1 ILE 17 3HD1 ILE 17 2.357 -4.710 -1.543
156 H GLU 18 H GLU 18 6.076 -3.516 -6.227
157 HA GLU 18 HA GLU 18 8.232 -5.230 -6.873
158 1HB GLU 18 2HB GLU 18 7.269 -2.628 -8.058
159 2HB GLU 18 1HB GLU 18 8.625 -3.531 -8.722
160 1HG GLU 18 2HG GLU 18 7.220 -5.402 -9.216
161 2HG GLU 18 1HG GLU 18 5.856 -4.651 -8.384
162 H THR 19 H THR 19 10.444 -4.460 -7.360
163 HA THR 19 HA THR 19 12.424 -3.488 -6.805
164 HB THR 19 HB THR 19 10.901 -1.369 -5.284
165 HG1 THR 19 1HG THR 19 10.062 -0.931 -7.186
166 1HG2 THR 19 1HG2 THR 19 13.574 -1.355 -6.690
167 2HG2 THR 19 2HG2 THR 19 13.317 -1.372 -4.946
168 3HG2 THR 19 3HG2 THR 19 12.829 0.033 -5.894
169 H HIS 20 H HIS 20 10.162 -3.183 -4.050
170 HA HIS 20 HA HIS 20 12.220 -4.417 -2.335
171 1HB HIS 20 2HB HIS 20 12.164 -1.947 -2.070
172 2HB HIS 20 1HB HIS 20 10.471 -2.055 -1.617
173 HD1 HIS 20 1HD HIS 20 13.864 -3.210 -0.371
174 HD2 HIS 20 2HD HIS 20 10.054 -2.339 1.039
175 HE1 HIS 20 1HE HIS 20 14.043 -3.245 2.137
176 HE2 HIS 20 2HE HIS 20 11.808 -2.400 2.934
177 HA PRO 21 HA PRO 21 8.161 -6.521 -1.720
178 1HB PRO 21 2HB PRO 21 8.852 -8.993 -2.452
179 2HB PRO 21 1HB PRO 21 8.538 -7.737 -3.655
180 1HG PRO 21 2HG PRO 21 11.132 -8.853 -2.714
181 2HG PRO 21 1HG PRO 21 10.671 -8.286 -4.327
182 1HD PRO 21 2HD PRO 21 12.122 -6.843 -2.397
183 2HD PRO 21 1HD PRO 21 11.396 -6.187 -3.874
184 H GLY 22 H GLY 22 10.605 -6.111 0.128
185 1HA GLY 22 2HA GLY 22 10.799 -8.552 1.629
186 2HA GLY 22 1HA GLY 22 11.508 -7.003 2.060
187 H LYS 23 H LYS 23 8.756 -9.081 2.344
188 HA LYS 23 HA LYS 23 7.784 -7.384 4.541
189 1HB LYS 23 2HB LYS 23 6.125 -8.913 2.528
190 2HB LYS 23 1HB LYS 23 5.482 -8.216 4.010
191 1HG LYS 23 2HG LYS 23 6.147 -5.996 3.267
192 2HG LYS 23 1HG LYS 23 6.802 -6.685 1.781
193 1HD LYS 23 2HD LYS 23 4.606 -7.430 1.114
194 2HD LYS 23 1HD LYS 23 3.922 -6.894 2.650
195 1HE LYS 23 2HE LYS 23 5.205 -5.121 0.577
196 2HE LYS 23 1HE LYS 23 3.471 -5.300 0.846
197 1HZ LYS 23 1HZ LYS 23 3.793 -4.451 3.106
198 2HZ LYS 23 2HZ LYS 23 4.290 -3.327 1.941
199 3HZ LYS 23 3HZ LYS 23 5.442 -4.224 2.793
200 H PHE 24 H PHE 24 6.992 -8.481 6.358
201 HA PHE 24 HA PHE 24 8.068 -11.178 6.588
202 1HB PHE 24 2HB PHE 24 8.590 -9.281 8.245
203 2HB PHE 24 1HB PHE 24 6.955 -9.526 8.853
204 HD1 PHE 24 1HD PHE 24 6.368 -11.560 10.058
205 HD2 PHE 24 2HD PHE 24 10.322 -10.904 8.628
206 HE1 PHE 24 1HE PHE 24 7.188 -13.371 11.507
207 HE2 PHE 24 2HE PHE 24 11.148 -12.715 10.073
208 HZ PHE 24 HZ PHE 24 9.580 -13.952 11.514
209 H THR 25 H THR 25 5.200 -9.599 8.017
210 HA THR 25 HA THR 25 3.538 -11.833 7.101
211 HB THR 25 HB THR 25 2.416 -11.737 9.418
212 HG1 THR 25 1HG THR 25 3.805 -11.056 11.097
213 1HG2 THR 25 1HG2 THR 25 3.696 -13.659 8.643
214 2HG2 THR 25 2HG2 THR 25 3.992 -13.361 10.357
215 3HG2 THR 25 3HG2 THR 25 5.193 -12.883 9.156
216 H ASP 26 H ASP 26 1.181 -11.117 8.354
217 HA ASP 26 HA ASP 26 0.292 -8.886 6.799
218 1HB ASP 26 2HB ASP 26 -1.901 -9.337 7.838
219 2HB ASP 26 1HB ASP 26 -1.168 -10.806 7.201
220 H ASP 27 H ASP 27 2.254 -8.452 9.070
221 HA ASP 27 HA ASP 27 0.872 -7.067 11.136
222 1HB ASP 27 2HB ASP 27 3.030 -8.114 11.545
223 2HB ASP 27 1HB ASP 27 3.790 -7.061 10.357
224 H PHE 28 H PHE 28 0.217 -5.028 11.225
225 HA PHE 28 HA PHE 28 0.152 -3.391 8.946
226 1HB PHE 28 2HB PHE 28 -0.365 -2.701 11.841
227 2HB PHE 28 1HB PHE 28 -0.732 -1.641 10.486
228 HD1 PHE 28 1HD PHE 28 -1.818 -4.445 12.463
229 HD2 PHE 28 2HD PHE 28 -2.450 -2.342 8.820
230 HE1 PHE 28 1HE PHE 28 -4.030 -5.497 12.248
231 HE2 PHE 28 2HE PHE 28 -4.668 -3.390 8.598
232 HZ PHE 28 HZ PHE 28 -5.458 -4.969 10.313
233 H ASP 29 H ASP 29 2.214 -3.323 11.816
234 HA ASP 29 HA ASP 29 3.431 -0.827 11.281
235 1HB ASP 29 2HB ASP 29 3.471 -1.932 13.504
236 2HB ASP 29 1HB ASP 29 4.548 -3.161 12.851
237 H THR 30 H THR 30 4.243 -4.139 10.453
238 HA THR 30 HA THR 30 6.706 -3.673 9.197
239 HB THR 30 HB THR 30 4.648 -5.788 8.529
240 HG1 THR 30 1HG THR 30 5.281 -5.772 10.759
241 1HG2 THR 30 1HG2 THR 30 7.642 -5.742 8.093
242 2HG2 THR 30 2HG2 THR 30 6.420 -5.571 6.834
243 3HG2 THR 30 3HG2 THR 30 6.558 -7.087 7.723
244 H ASN 31 H ASN 31 3.391 -3.739 7.829
245 HA ASN 31 HA ASN 31 4.207 -3.069 5.211
246 1HB ASN 31 2HB ASN 31 1.592 -2.885 6.677
247 2HB ASN 31 1HB ASN 31 1.758 -2.244 5.042
248 1HD2 ASN 31 1HD2 ASN 31 0.234 -4.570 6.146
249 2HD2 ASN 31 2HD2 ASN 31 0.746 -5.914 5.184
250 H LYS 32 H LYS 32 3.310 -1.117 8.005
251 HA LYS 32 HA LYS 32 3.430 1.427 6.831
252 1HB LYS 32 2HB LYS 32 2.607 1.037 9.112
253 2HB LYS 32 1HB LYS 32 4.221 0.569 9.626
254 1HG LYS 32 2HG LYS 32 4.727 3.027 8.632
255 2HG LYS 32 1HG LYS 32 3.068 3.239 9.196
256 1HD LYS 32 2HD LYS 32 5.369 2.194 10.843
257 2HD LYS 32 1HD LYS 32 4.704 3.826 10.927
258 1HE LYS 32 2HE LYS 32 2.611 2.998 11.747
259 2HE LYS 32 1HE LYS 32 3.107 1.329 11.470
260 1HZ LYS 32 1HZ LYS 32 4.769 1.533 13.168
261 2HZ LYS 32 2HZ LYS 32 3.281 2.020 13.817
262 3HZ LYS 32 3HZ LYS 32 4.433 3.182 13.376
263 H LYS 33 H LYS 33 5.933 -0.660 8.129
264 HA LYS 33 HA LYS 33 8.118 1.043 8.102
265 1HB LYS 33 2HB LYS 33 8.173 -1.140 9.150
266 2HB LYS 33 1HB LYS 33 7.952 -1.932 7.599
267 1HG LYS 33 2HG LYS 33 10.267 -0.252 7.501
268 2HG LYS 33 1HG LYS 33 10.356 -1.319 8.904
269 1HD LYS 33 2HD LYS 33 9.876 -3.241 7.420
270 2HD LYS 33 1HD LYS 33 9.910 -2.145 6.038
271 1HE LYS 33 2HE LYS 33 12.190 -2.667 7.936
272 2HE LYS 33 1HE LYS 33 12.032 -3.329 6.309
273 1HZ LYS 33 1HZ LYS 33 13.500 -1.389 6.383
274 2HZ LYS 33 2HZ LYS 33 12.223 -0.433 6.961
275 3HZ LYS 33 3HZ LYS 33 12.141 -1.106 5.406
276 H LEU 34 H LEU 34 6.821 -0.982 5.480
277 HA LEU 34 HA LEU 34 8.845 -0.175 3.624
278 1HB LEU 34 2HB LEU 34 6.252 -1.647 3.330
279 2HB LEU 34 1HB LEU 34 7.125 -1.098 1.913
280 HG LEU 34 HG LEU 34 9.133 -2.377 2.870
281 1HD1 LEU 34 1HD1 LEU 34 8.275 -2.714 5.117
282 2HD1 LEU 34 2HD1 LEU 34 8.589 -4.258 4.321
283 3HD1 LEU 34 3HD1 LEU 34 6.935 -3.664 4.472
284 1HD2 LEU 34 1HD2 LEU 34 8.344 -4.485 1.899
285 2HD2 LEU 34 2HD2 LEU 34 7.913 -3.094 0.900
286 3HD2 LEU 34 3HD2 LEU 34 6.693 -3.867 1.913
287 H VAL 35 H VAL 35 5.652 1.033 4.444
288 HA VAL 35 HA VAL 35 5.382 2.825 2.256
289 HB VAL 35 HB VAL 35 4.210 3.092 5.037
290 1HG1 VAL 35 1HG1 VAL 35 2.519 4.503 3.973
291 2HG1 VAL 35 2HG1 VAL 35 3.371 4.370 2.434
292 3HG1 VAL 35 3HG1 VAL 35 4.134 5.192 3.796
293 1HG2 VAL 35 1HG2 VAL 35 3.055 1.841 2.550
294 2HG2 VAL 35 2HG2 VAL 35 2.199 2.082 4.073
295 3HG2 VAL 35 3HG2 VAL 35 3.578 0.985 4.000
296 H GLU 36 H GLU 36 6.965 3.007 5.365
297 HA GLU 36 HA GLU 36 7.648 5.726 5.413
298 1HB GLU 36 2HB GLU 36 7.977 4.226 7.329
299 2HB GLU 36 1HB GLU 36 9.194 3.329 6.435
300 1HG GLU 36 2HG GLU 36 10.421 4.692 7.856
301 2HG GLU 36 1HG GLU 36 10.468 5.546 6.315
302 H GLU 37 H GLU 37 9.272 2.933 3.978
303 HA GLU 37 HA GLU 37 11.569 4.365 3.111
304 1HB GLU 37 2HB GLU 37 10.475 1.708 2.172
305 2HB GLU 37 1HB GLU 37 12.084 2.322 1.826
306 1HG GLU 37 2HG GLU 37 12.573 2.302 4.242
307 2HG GLU 37 1HG GLU 37 10.979 1.609 4.532
308 H PHE 38 H PHE 38 8.686 3.159 1.389
309 HA PHE 38 HA PHE 38 9.582 4.711 -0.945
310 1HB PHE 38 2HB PHE 38 7.979 2.154 -0.802
311 2HB PHE 38 1HB PHE 38 8.211 3.076 -2.286
312 HD1 PHE 38 1HD PHE 38 9.924 1.090 0.297
313 HD2 PHE 38 2HD PHE 38 10.244 3.018 -3.482
314 HE1 PHE 38 1HE PHE 38 12.072 -0.035 -0.093
315 HE2 PHE 38 2HE PHE 38 12.393 1.891 -3.878
316 HZ PHE 38 HZ PHE 38 13.311 0.366 -2.183
317 H SER 39 H SER 39 6.769 3.925 -2.043
318 HA SER 39 HA SER 39 4.822 4.990 -2.409
319 1HB SER 39 2HB SER 39 4.416 4.712 0.037
320 2HB SER 39 1HB SER 39 5.184 6.275 0.310
321 HG SER 39 HG SER 39 3.207 6.970 0.068
322 H THR 40 H THR 40 3.930 7.400 -2.515
323 HA THR 40 HA THR 40 6.221 9.005 -3.436
324 HB THR 40 HB THR 40 3.396 9.204 -4.489
325 HG1 THR 40 1HG THR 40 4.446 8.075 -6.351
326 1HG2 THR 40 1HG2 THR 40 6.045 10.214 -5.531
327 2HG2 THR 40 2HG2 THR 40 4.752 11.199 -4.845
328 3HG2 THR 40 3HG2 THR 40 4.503 10.354 -6.374
329 H VAL 41 H VAL 41 2.836 9.966 -2.956
330 HA VAL 41 HA VAL 41 3.819 12.035 -1.121
331 HB VAL 41 HB VAL 41 2.761 13.015 -3.045
332 1HG1 VAL 41 1HG1 VAL 41 0.445 12.607 -3.667
333 2HG1 VAL 41 2HG1 VAL 41 0.303 11.395 -2.395
334 3HG1 VAL 41 3HG1 VAL 41 1.390 11.120 -3.756
335 1HG2 VAL 41 1HG2 VAL 41 0.928 13.187 -0.658
336 2HG2 VAL 41 2HG2 VAL 41 1.004 14.346 -1.985
337 3HG2 VAL 41 3HG2 VAL 41 2.392 14.135 -0.919
338 H SER 42 H SER 42 3.817 10.918 0.773
339 HA SER 42 HA SER 42 1.307 9.650 1.610
340 1HB SER 42 2HB SER 42 4.016 9.333 2.909
341 2HB SER 42 1HB SER 42 2.595 8.301 3.098
342 HG SER 42 HG SER 42 4.561 8.015 1.387
343 H THR 43 H THR 43 0.081 11.069 2.711
344 HA THR 43 HA THR 43 1.227 12.967 4.533
345 HB THR 43 HB THR 43 -1.377 12.950 5.234
346 HG1 THR 43 1HG THR 43 -1.540 12.363 2.473
347 1HG2 THR 43 1HG2 THR 43 -1.707 14.734 3.575
348 2HG2 THR 43 2HG2 THR 43 -0.232 14.231 2.749
349 3HG2 THR 43 3HG2 THR 43 -0.147 14.882 4.386
350 H LYS 44 H LYS 44 0.449 12.957 6.878
351 HA LYS 44 HA LYS 44 1.731 10.714 7.994
352 1HB LYS 44 2HB LYS 44 0.251 13.021 9.232
353 2HB LYS 44 1HB LYS 44 1.051 11.780 10.193
354 1HG LYS 44 2HG LYS 44 3.185 12.343 9.271
355 2HG LYS 44 1HG LYS 44 2.446 13.433 8.100
356 1HD LYS 44 2HD LYS 44 1.734 14.916 9.873
357 2HD LYS 44 1HD LYS 44 2.358 13.801 11.092
358 1HE LYS 44 2HE LYS 44 3.899 15.656 10.714
359 2HE LYS 44 1HE LYS 44 4.618 14.117 10.249
360 1HZ LYS 44 1HZ LYS 44 3.456 16.139 8.405
361 2HZ LYS 44 2HZ LYS 44 4.066 14.632 7.930
362 3HZ LYS 44 3HZ LYS 44 5.100 15.787 8.603
363 H HIS 45 H HIS 45 -1.686 11.457 7.635
364 HA HIS 45 HA HIS 45 -2.348 9.125 9.277
365 1HB HIS 45 2HB HIS 45 -3.628 11.207 9.632
366 2HB HIS 45 1HB HIS 45 -4.195 11.134 7.968
367 HD1 HIS 45 1HD HIS 45 -6.596 10.569 8.118
368 HD2 HIS 45 2HD HIS 45 -4.295 8.268 10.710
369 HE1 HIS 45 1HE HIS 45 -8.180 8.896 9.137
370 HE2 HIS 45 2HE HIS 45 -6.729 7.406 10.559
371 H LEU 46 H LEU 46 -2.075 10.082 5.977
372 HA LEU 46 HA LEU 46 -3.729 8.045 4.857
373 1HB LEU 46 2HB LEU 46 -3.070 10.057 3.604
374 2HB LEU 46 1HB LEU 46 -1.399 9.527 3.631
375 HG LEU 46 HG LEU 46 -2.072 7.521 2.302
376 1HD1 LEU 46 1HD1 LEU 46 -4.711 8.970 2.126
377 2HD1 LEU 46 2HD1 LEU 46 -4.417 7.418 2.910
378 3HD1 LEU 46 3HD1 LEU 46 -4.247 7.570 1.161
379 1HD2 LEU 46 1HD2 LEU 46 -1.101 9.466 1.214
380 2HD2 LEU 46 2HD2 LEU 46 -2.698 10.203 1.075
381 3HD2 LEU 46 3HD2 LEU 46 -2.326 8.727 0.185
382 H ARG 47 H ARG 47 -0.469 8.207 6.018
383 HA ARG 47 HA ARG 47 0.706 5.995 4.830
384 1HB ARG 47 2HB ARG 47 1.805 7.665 6.368
385 2HB ARG 47 1HB ARG 47 1.059 6.820 7.716
386 1HG ARG 47 2HG ARG 47 2.253 4.764 7.020
387 2HG ARG 47 1HG ARG 47 3.085 5.714 5.787
388 1HD ARG 47 2HD ARG 47 3.235 6.025 8.779
389 2HD ARG 47 1HD ARG 47 4.529 5.561 7.678
390 HE ARG 47 HE ARG 47 3.327 8.255 7.813
391 1HH1 ARG 47 1HH1 ARG 47 6.037 6.135 7.191
392 2HH1 ARG 47 2HH1 ARG 47 7.163 7.429 6.913
393 1HH2 ARG 47 1HH2 ARG 47 4.774 9.964 7.423
394 2HH2 ARG 47 2HH2 ARG 47 6.433 9.619 7.031
395 H ASN 48 H ASN 48 -1.400 6.187 7.652
396 HA ASN 48 HA ASN 48 -1.282 3.480 8.409
397 1HB ASN 48 2HB ASN 48 -3.467 5.535 8.814
398 2HB ASN 48 1HB ASN 48 -3.415 3.972 9.616
399 1HD2 ASN 48 1HD2 ASN 48 -1.994 3.643 11.286
400 2HD2 ASN 48 2HD2 ASN 48 -1.096 4.924 12.027
401 H LYS 49 H LYS 49 -3.384 5.245 6.192
402 HA LYS 49 HA LYS 49 -5.182 3.140 5.646
403 1HB LYS 49 2HB LYS 49 -4.389 5.580 4.064
404 2HB LYS 49 1HB LYS 49 -5.617 4.453 3.511
405 1HG LYS 49 2HG LYS 49 -6.949 4.922 5.495
406 2HG LYS 49 1HG LYS 49 -5.700 6.027 6.073
407 1HD LYS 49 2HD LYS 49 -6.069 7.528 4.275
408 2HD LYS 49 1HD LYS 49 -7.071 6.359 3.415
409 1HE LYS 49 2HE LYS 49 -7.780 7.595 6.071
410 2HE LYS 49 1HE LYS 49 -8.354 8.181 4.510
411 1HZ LYS 49 1HZ LYS 49 -9.252 5.865 4.169
412 2HZ LYS 49 2HZ LYS 49 -10.039 6.808 5.333
413 3HZ LYS 49 3HZ LYS 49 -8.959 5.592 5.821
414 H ILE 50 H ILE 50 -2.237 4.235 3.974
415 HA ILE 50 HA ILE 50 -2.331 2.357 1.881
416 HB ILE 50 HB ILE 50 0.132 3.626 3.099
417 1HG1 ILE 50 2HG1 ILE 50 -1.571 4.513 0.758
418 2HG1 ILE 50 1HG1 ILE 50 -1.558 5.271 2.346
419 1HG2 ILE 50 1HG2 ILE 50 0.655 1.688 1.708
420 2HG2 ILE 50 2HG2 ILE 50 1.180 3.183 0.934
421 3HG2 ILE 50 3HG2 ILE 50 -0.289 2.376 0.385
422 1HD1 ILE 50 1HD1 ILE 50 -0.243 6.548 0.784
423 2HD1 ILE 50 2HD1 ILE 50 0.744 5.132 0.419
424 3HD1 ILE 50 3HD1 ILE 50 0.796 5.854 2.028
425 H ALA 51 H ALA 51 -0.786 2.241 5.069
426 HA ALA 51 HA ALA 51 0.473 -0.247 4.811
427 1HB ALA 51 1HB ALA 51 0.538 -0.295 7.233
428 2HB ALA 51 2HB ALA 51 -0.686 0.970 7.315
429 3HB ALA 51 3HB ALA 51 0.908 1.327 6.650
430 H GLY 52 H GLY 52 -2.796 0.589 5.923
431 1HA GLY 52 2HA GLY 52 -3.609 -2.061 6.512
432 2HA GLY 52 1HA GLY 52 -4.679 -0.703 6.196
433 H TYR 53 H TYR 53 -3.750 -0.116 3.581
434 HA TYR 53 HA TYR 53 -5.348 -1.807 2.025
435 1HB TYR 53 2HB TYR 53 -4.733 0.512 1.401
436 2HB TYR 53 1HB TYR 53 -3.083 -0.019 1.105
437 HD1 TYR 53 1HD TYR 53 -6.591 -0.580 -0.007
438 HD2 TYR 53 2HD TYR 53 -2.465 -0.763 -1.020
439 HE1 TYR 53 1HE TYR 53 -7.194 -1.071 -2.341
440 HE2 TYR 53 2HE TYR 53 -3.051 -1.260 -3.356
441 HH TYR 53 HH TYR 53 -4.937 -2.193 -4.638
442 H ILE 54 H ILE 54 -1.810 -1.693 2.394
443 HA ILE 54 HA ILE 54 -1.198 -3.815 0.656
444 HB ILE 54 HB ILE 54 0.313 -3.196 3.191
445 1HG1 ILE 54 2HG1 ILE 54 0.738 -1.929 0.480
446 2HG1 ILE 54 1HG1 ILE 54 -0.128 -1.144 1.800
447 1HG2 ILE 54 1HG2 ILE 54 2.231 -4.018 1.893
448 2HG2 ILE 54 2HG2 ILE 54 1.155 -4.360 0.539
449 3HG2 ILE 54 3HG2 ILE 54 0.970 -5.239 2.056
450 1HD1 ILE 54 1HD1 ILE 54 1.885 -1.305 3.186
451 2HD1 ILE 54 2HD1 ILE 54 2.152 -0.371 1.712
452 3HD1 ILE 54 3HD1 ILE 54 2.746 -2.029 1.826
453 H THR 55 H THR 55 -1.589 -3.807 4.194
454 HA THR 55 HA THR 55 -1.427 -6.451 4.799
455 HB THR 55 HB THR 55 -3.578 -4.652 5.924
456 HG1 THR 55 1HG THR 55 -1.763 -3.446 6.172
457 1HG2 THR 55 1HG2 THR 55 -3.629 -7.008 6.647
458 2HG2 THR 55 2HG2 THR 55 -3.208 -5.915 7.967
459 3HG2 THR 55 3HG2 THR 55 -1.950 -6.861 7.173
460 H ARG 56 H ARG 56 -4.317 -4.797 3.520
461 HA ARG 56 HA ARG 56 -6.004 -7.036 3.483
462 1HB ARG 56 2HB ARG 56 -7.034 -4.933 3.171
463 2HB ARG 56 1HB ARG 56 -5.955 -4.512 1.845
464 1HG ARG 56 2HG ARG 56 -7.012 -6.077 0.387
465 2HG ARG 56 1HG ARG 56 -7.965 -6.745 1.710
466 1HD ARG 56 2HD ARG 56 -8.177 -3.861 0.913
467 2HD ARG 56 1HD ARG 56 -9.116 -5.113 0.106
468 HE ARG 56 HE ARG 56 -9.278 -4.816 3.032
469 1HH1 ARG 56 1HH1 ARG 56 -10.797 -4.707 -0.136
470 2HH1 ARG 56 2HH1 ARG 56 -12.415 -4.625 0.511
471 1HH2 ARG 56 1HH2 ARG 56 -11.422 -4.703 3.867
472 2HH2 ARG 56 2HH2 ARG 56 -12.761 -4.613 2.760
473 H ILE 57 H ILE 57 -3.814 -5.762 0.985
474 HA ILE 57 HA ILE 57 -4.397 -7.596 -1.039
475 HB ILE 57 HB ILE 57 -1.715 -6.335 -0.426
476 1HG1 ILE 57 2HG1 ILE 57 -3.927 -5.423 -2.281
477 2HG1 ILE 57 1HG1 ILE 57 -3.545 -4.696 -0.721
478 1HG2 ILE 57 1HG2 ILE 57 -1.245 -6.705 -2.817
479 2HG2 ILE 57 2HG2 ILE 57 -2.766 -7.590 -2.959
480 3HG2 ILE 57 3HG2 ILE 57 -1.476 -8.214 -1.932
481 1HD1 ILE 57 1HD1 ILE 57 -1.362 -4.037 -1.552
482 2HD1 ILE 57 2HD1 ILE 57 -2.646 -3.401 -2.579
483 3HD1 ILE 57 3HD1 ILE 57 -1.706 -4.800 -3.105
484 H ILE 58 H ILE 58 -2.145 -7.813 1.673
485 HA ILE 58 HA ILE 58 -0.954 -10.258 1.035
486 HB ILE 58 HB ILE 58 -1.530 -9.107 3.769
487 1HG1 ILE 58 2HG1 ILE 58 0.963 -8.977 2.053
488 2HG1 ILE 58 1HG1 ILE 58 -0.168 -7.652 2.309
489 1HG2 ILE 58 1HG2 ILE 58 0.280 -10.561 4.565
490 2HG2 ILE 58 2HG2 ILE 58 0.392 -11.288 2.960
491 3HG2 ILE 58 3HG2 ILE 58 -1.075 -11.488 3.921
492 1HD1 ILE 58 1HD1 ILE 58 1.823 -7.412 3.681
493 2HD1 ILE 58 2HD1 ILE 58 1.500 -8.973 4.437
494 3HD1 ILE 58 3HD1 ILE 58 0.385 -7.627 4.677
495 H SER 59 H SER 59 -3.817 -9.597 3.068
496 HA SER 59 HA SER 59 -4.368 -12.314 3.614
497 1HB SER 59 2HB SER 59 -6.662 -11.435 4.241
498 2HB SER 59 1HB SER 59 -5.299 -10.694 5.079
499 HG SER 59 HG SER 59 -5.942 -9.403 2.753
500 H GLN 60 H GLN 60 -4.865 -10.464 0.781
501 HA GLN 60 HA GLN 60 -6.985 -12.160 -0.238
502 1HB GLN 60 2HB GLN 60 -5.343 -10.029 -1.624
503 2HB GLN 60 1HB GLN 60 -6.721 -10.863 -2.328
504 1HG GLN 60 2HG GLN 60 -6.774 -9.059 0.078
505 2HG GLN 60 1HG GLN 60 -7.337 -8.658 -1.543
506 1HE2 GLN 60 1HE2 GLN 60 -8.774 -8.698 0.992
507 2HE2 GLN 60 2HE2 GLN 60 -10.116 -9.767 0.768
508 H GLN 61 H GLN 61 -3.518 -11.726 -0.648
509 HA GLN 61 HA GLN 61 -3.378 -13.655 -2.787
510 1HB GLN 61 2HB GLN 61 -1.930 -11.574 -2.539
511 2HB GLN 61 1HB GLN 61 -1.062 -12.442 -1.282
512 1HG GLN 61 2HG GLN 61 -1.379 -13.702 -3.963
513 2HG GLN 61 1HG GLN 61 -0.198 -12.414 -3.749
514 1HE2 GLN 61 1HE2 GLN 61 0.149 -15.271 -4.342
515 2HE2 GLN 61 2HE2 GLN 61 1.201 -15.871 -3.094
516 H LYS 62 H LYS 62 -2.719 -13.570 0.672
517 HA LYS 62 HA LYS 62 -1.801 -16.336 0.639
518 1HB LYS 62 2HB LYS 62 -1.754 -14.125 2.565
519 2HB LYS 62 1HB LYS 62 -2.161 -15.672 3.291
520 1HG LYS 62 2HG LYS 62 0.217 -15.282 3.427
521 2HG LYS 62 1HG LYS 62 -0.112 -16.642 2.354
522 1HD LYS 62 2HD LYS 62 0.089 -15.086 0.425
523 2HD LYS 62 1HD LYS 62 0.575 -13.819 1.552
524 1HE LYS 62 2HE LYS 62 2.496 -15.156 2.240
525 2HE LYS 62 1HE LYS 62 2.002 -16.444 1.140
526 1HZ LYS 62 1HZ LYS 62 2.257 -14.863 -0.706
527 2HZ LYS 62 2HZ LYS 62 3.713 -15.135 0.118
528 3HZ LYS 62 3HZ LYS 62 2.843 -13.698 0.382
Start of MODEL 7
1 1H MET 1 1HT MET 1 -14.860 12.559 -5.449
2 2H MET 1 2HT MET 1 -15.938 11.905 -6.589
3 3H MET 1 3HT MET 1 -14.825 13.095 -7.058
4 HA MET 1 HA MET 1 -12.990 11.626 -6.616
5 1HB MET 1 2HB MET 1 -13.476 9.209 -6.184
6 2HB MET 1 1HB MET 1 -13.875 10.271 -4.845
7 1HG MET 1 2HG MET 1 -15.946 9.397 -6.827
8 2HG MET 1 1HG MET 1 -15.509 8.403 -5.440
9 1HE MET 1 1HE MET 1 -16.505 10.659 -2.420
10 2HE MET 1 2HE MET 1 -14.921 10.477 -3.178
11 3HE MET 1 3HE MET 1 -15.946 9.065 -2.927
12 H GLY 2 H GLY 2 -14.308 12.703 -8.797
13 1HA GLY 2 2HA GLY 2 -14.871 10.582 -10.687
14 2HA GLY 2 1HA GLY 2 -14.798 12.306 -11.037
15 H ASN 3 H ASN 3 -13.638 10.071 -12.507
16 HA ASN 3 HA ASN 3 -11.795 9.706 -13.776
17 1HB ASN 3 2HB ASN 3 -11.431 12.126 -13.842
18 2HB ASN 3 1HB ASN 3 -10.584 12.058 -12.300
19 1HD2 ASN 3 1HD2 ASN 3 -8.477 11.377 -12.241
20 2HD2 ASN 3 2HD2 ASN 3 -7.537 11.080 -13.658
21 H ILE 4 H ILE 4 -10.765 10.537 -10.462
22 HA ILE 4 HA ILE 4 -9.044 8.187 -10.449
23 HB ILE 4 HB ILE 4 -8.014 10.110 -9.490
24 1HG1 ILE 4 2HG1 ILE 4 -8.889 8.296 -7.239
25 2HG1 ILE 4 1HG1 ILE 4 -7.595 7.941 -8.378
26 1HG2 ILE 4 1HG2 ILE 4 -8.917 11.326 -7.572
27 2HG2 ILE 4 2HG2 ILE 4 -10.371 10.329 -7.631
28 3HG2 ILE 4 3HG2 ILE 4 -9.993 11.416 -8.967
29 1HD1 ILE 4 1HD1 ILE 4 -7.645 10.221 -6.410
30 2HD1 ILE 4 2HD1 ILE 4 -6.350 9.870 -7.554
31 3HD1 ILE 4 3HD1 ILE 4 -6.715 8.729 -6.259
32 H ARG 5 H ARG 5 -10.139 6.378 -10.219
33 HA ARG 5 HA ARG 5 -12.601 6.348 -8.674
34 1HB ARG 5 2HB ARG 5 -12.232 5.313 -11.010
35 2HB ARG 5 1HB ARG 5 -11.406 4.017 -10.158
36 1HG ARG 5 2HG ARG 5 -13.434 3.528 -8.905
37 2HG ARG 5 1HG ARG 5 -14.269 4.855 -9.719
38 1HD ARG 5 2HD ARG 5 -13.815 3.722 -11.888
39 2HD ARG 5 1HD ARG 5 -13.143 2.362 -10.990
40 HE ARG 5 HE ARG 5 -15.925 3.220 -10.531
41 1HH1 ARG 5 1HH1 ARG 5 -13.604 0.793 -11.533
42 2HH1 ARG 5 2HH1 ARG 5 -14.775 -0.485 -11.609
43 1HH2 ARG 5 1HH2 ARG 5 -17.485 1.515 -10.653
44 2HH2 ARG 5 2HH2 ARG 5 -16.957 -0.083 -11.108
45 H THR 6 H THR 6 -9.880 4.048 -8.911
46 HA THR 6 HA THR 6 -9.381 4.034 -6.089
47 HB THR 6 HB THR 6 -10.610 1.521 -7.260
48 HG1 THR 6 1HG THR 6 -11.740 3.666 -6.008
49 1HG2 THR 6 1HG2 THR 6 -10.490 0.685 -4.939
50 2HG2 THR 6 2HG2 THR 6 -9.631 2.156 -4.476
51 3HG2 THR 6 3HG2 THR 6 -8.897 1.026 -5.616
52 H SER 7 H SER 7 -9.097 2.366 -9.170
53 HA SER 7 HA SER 7 -7.011 0.642 -8.712
54 1HB SER 7 2HB SER 7 -6.594 1.053 -11.251
55 2HB SER 7 1HB SER 7 -8.142 0.382 -10.730
56 HG SER 7 HG SER 7 -8.313 2.178 -12.233
57 H PHE 8 H PHE 8 -6.814 4.046 -9.678
58 HA PHE 8 HA PHE 8 -4.090 4.158 -10.251
59 1HB PHE 8 2HB PHE 8 -5.688 5.951 -10.807
60 2HB PHE 8 1HB PHE 8 -5.838 6.344 -9.099
61 HD1 PHE 8 1HD PHE 8 -4.504 7.998 -8.206
62 HD2 PHE 8 2HD PHE 8 -3.269 6.049 -11.781
63 HE1 PHE 8 1HE PHE 8 -2.612 9.560 -8.401
64 HE2 PHE 8 2HE PHE 8 -1.374 7.606 -11.983
65 HZ PHE 8 HZ PHE 8 -1.044 9.368 -10.297
66 H VAL 9 H VAL 9 -5.780 4.492 -7.170
67 HA VAL 9 HA VAL 9 -3.490 5.306 -5.688
68 HB VAL 9 HB VAL 9 -6.037 4.026 -4.670
69 1HG1 VAL 9 1HG1 VAL 9 -5.463 5.108 -2.544
70 2HG1 VAL 9 2HG1 VAL 9 -3.940 5.654 -3.243
71 3HG1 VAL 9 3HG1 VAL 9 -4.248 3.930 -3.034
72 1HG2 VAL 9 1HG2 VAL 9 -6.773 6.321 -4.215
73 2HG2 VAL 9 2HG2 VAL 9 -6.511 6.046 -5.938
74 3HG2 VAL 9 3HG2 VAL 9 -5.315 6.938 -4.996
75 H LYS 10 H LYS 10 -5.114 2.211 -6.206
76 HA LYS 10 HA LYS 10 -3.434 0.714 -4.478
77 1HB LYS 10 2HB LYS 10 -5.713 0.011 -5.254
78 2HB LYS 10 1HB LYS 10 -5.023 -0.310 -6.837
79 1HG LYS 10 2HG LYS 10 -3.610 -2.031 -5.921
80 2HG LYS 10 1HG LYS 10 -4.154 -1.654 -4.287
81 1HD LYS 10 2HD LYS 10 -6.445 -2.293 -4.926
82 2HD LYS 10 1HD LYS 10 -5.860 -2.714 -6.539
83 1HE LYS 10 2HE LYS 10 -4.386 -4.405 -5.559
84 2HE LYS 10 1HE LYS 10 -4.964 -3.978 -3.950
85 1HZ LYS 10 1HZ LYS 10 -6.053 -5.962 -4.866
86 2HZ LYS 10 2HZ LYS 10 -6.680 -5.029 -6.136
87 3HZ LYS 10 3HZ LYS 10 -7.159 -4.720 -4.538
88 H ARG 11 H ARG 11 -3.217 1.691 -7.828
89 HA ARG 11 HA ARG 11 -1.136 -0.001 -8.663
90 1HB ARG 11 2HB ARG 11 -2.297 1.315 -10.310
91 2HB ARG 11 1HB ARG 11 -1.855 2.813 -9.501
92 1HG ARG 11 2HG ARG 11 0.539 2.248 -9.964
93 2HG ARG 11 1HG ARG 11 -0.042 0.927 -10.973
94 1HD ARG 11 2HD ARG 11 -0.953 2.370 -12.554
95 2HD ARG 11 1HD ARG 11 -0.997 3.730 -11.427
96 HE ARG 11 HE ARG 11 1.646 3.196 -11.616
97 1HH1 ARG 11 1HH1 ARG 11 -0.831 3.722 -14.058
98 2HH1 ARG 11 2HH1 ARG 11 0.267 4.483 -15.174
99 1HH2 ARG 11 1HH2 ARG 11 3.079 4.155 -13.095
100 2HH2 ARG 11 2HH2 ARG 11 2.493 4.707 -14.641
101 H ILE 12 H ILE 12 -0.998 3.294 -7.300
102 HA ILE 12 HA ILE 12 1.786 3.550 -7.294
103 HB ILE 12 HB ILE 12 -0.164 4.771 -5.326
104 1HG1 ILE 12 2HG1 ILE 12 0.877 5.840 -7.959
105 2HG1 ILE 12 1HG1 ILE 12 -0.746 5.215 -7.686
106 1HG2 ILE 12 1HG2 ILE 12 2.136 4.958 -4.567
107 2HG2 ILE 12 2HG2 ILE 12 1.530 6.533 -5.081
108 3HG2 ILE 12 3HG2 ILE 12 2.617 5.622 -6.130
109 1HD1 ILE 12 1HD1 ILE 12 -0.732 7.636 -7.679
110 2HD1 ILE 12 2HD1 ILE 12 0.456 7.646 -6.377
111 3HD1 ILE 12 3HD1 ILE 12 -1.164 7.018 -6.085
112 H ALA 13 H ALA 13 -0.410 2.132 -4.949
113 HA ALA 13 HA ALA 13 1.403 1.735 -2.850
114 1HB ALA 13 1HB ALA 13 -1.017 1.530 -2.583
115 2HB ALA 13 2HB ALA 13 -0.185 0.081 -2.016
116 3HB ALA 13 3HB ALA 13 -1.004 0.073 -3.577
117 H LYS 14 H LYS 14 0.521 -0.418 -5.573
118 HA LYS 14 HA LYS 14 2.186 -2.539 -4.663
119 1HB LYS 14 2HB LYS 14 1.688 -3.675 -6.673
120 2HB LYS 14 1HB LYS 14 0.240 -2.754 -6.295
121 1HG LYS 14 2HG LYS 14 0.565 -1.268 -8.027
122 2HG LYS 14 1HG LYS 14 2.297 -1.596 -8.118
123 1HD LYS 14 2HD LYS 14 1.670 -3.921 -8.905
124 2HD LYS 14 1HD LYS 14 0.021 -3.316 -9.081
125 1HE LYS 14 2HE LYS 14 0.771 -1.625 -10.639
126 2HE LYS 14 1HE LYS 14 2.446 -2.112 -10.408
127 1HZ LYS 14 1HZ LYS 14 0.278 -3.688 -11.677
128 2HZ LYS 14 2HZ LYS 14 1.797 -4.332 -11.285
129 3HZ LYS 14 3HZ LYS 14 1.677 -3.071 -12.417
130 H GLU 15 H GLU 15 2.703 0.223 -6.766
131 HA GLU 15 HA GLU 15 5.188 -0.683 -7.816
132 1HB GLU 15 2HB GLU 15 4.057 2.119 -7.640
133 2HB GLU 15 1HB GLU 15 5.484 1.663 -8.566
134 1HG GLU 15 2HG GLU 15 3.996 0.037 -9.804
135 2HG GLU 15 1HG GLU 15 2.632 0.837 -9.028
136 H MET 16 H MET 16 4.248 0.926 -4.889
137 HA MET 16 HA MET 16 6.889 1.575 -4.031
138 1HB MET 16 2HB MET 16 4.334 1.037 -2.502
139 2HB MET 16 1HB MET 16 5.841 1.504 -1.724
140 1HG MET 16 2HG MET 16 5.845 3.596 -2.963
141 2HG MET 16 1HG MET 16 4.348 3.130 -3.770
142 1HE MET 16 1HE MET 16 4.684 5.894 -2.265
143 2HE MET 16 2HE MET 16 3.165 5.988 -1.377
144 3HE MET 16 3HE MET 16 3.180 5.392 -3.037
145 H ILE 17 H ILE 17 4.758 -1.197 -3.557
146 HA ILE 17 HA ILE 17 6.431 -2.610 -1.783
147 HB ILE 17 HB ILE 17 4.220 -3.661 -3.556
148 1HG1 ILE 17 2HG1 ILE 17 4.177 -2.770 -0.661
149 2HG1 ILE 17 1HG1 ILE 17 3.531 -1.849 -2.015
150 1HG2 ILE 17 1HG2 ILE 17 5.682 -5.454 -2.756
151 2HG2 ILE 17 2HG2 ILE 17 4.095 -5.536 -1.994
152 3HG2 ILE 17 3HG2 ILE 17 5.469 -4.890 -1.096
153 1HD1 ILE 17 1HD1 ILE 17 1.919 -3.646 -2.443
154 2HD1 ILE 17 2HD1 ILE 17 1.753 -2.963 -0.825
155 3HD1 ILE 17 3HD1 ILE 17 2.548 -4.522 -1.047
156 H GLU 18 H GLU 18 6.290 -2.529 -5.289
157 HA GLU 18 HA GLU 18 7.513 -4.990 -5.835
158 1HB GLU 18 2HB GLU 18 7.974 -4.128 -8.055
159 2HB GLU 18 1HB GLU 18 6.362 -3.648 -7.544
160 1HG GLU 18 2HG GLU 18 7.107 -1.427 -7.077
161 2HG GLU 18 1HG GLU 18 8.786 -1.879 -7.368
162 H THR 19 H THR 19 8.902 -2.192 -4.471
163 HA THR 19 HA THR 19 11.558 -2.557 -5.469
164 HB THR 19 HB THR 19 12.219 -0.953 -3.710
165 HG1 THR 19 1HG THR 19 9.472 -0.726 -3.016
166 1HG2 THR 19 1HG2 THR 19 11.398 -0.134 -5.863
167 2HG2 THR 19 2HG2 THR 19 10.935 0.952 -4.554
168 3HG2 THR 19 3HG2 THR 19 9.747 -0.151 -5.246
169 H HIS 20 H HIS 20 9.703 -3.856 -2.840
170 HA HIS 20 HA HIS 20 11.887 -5.661 -2.218
171 1HB HIS 20 2HB HIS 20 12.261 -3.799 -0.652
172 2HB HIS 20 1HB HIS 20 10.605 -3.943 -0.076
173 HD1 HIS 20 1HD HIS 20 11.407 -4.423 2.338
174 HD2 HIS 20 2HD HIS 20 12.733 -7.187 -0.477
175 HE1 HIS 20 1HE HIS 20 12.287 -6.371 3.658
176 HE2 HIS 20 2HE HIS 20 13.298 -7.916 1.942
177 HA PRO 21 HA PRO 21 7.833 -7.778 -2.297
178 1HB PRO 21 2HB PRO 21 9.294 -9.983 -3.501
179 2HB PRO 21 1HB PRO 21 8.015 -8.989 -4.206
180 1HG PRO 21 2HG PRO 21 10.598 -8.899 -5.046
181 2HG PRO 21 1HG PRO 21 9.501 -7.511 -5.137
182 1HD PRO 21 2HD PRO 21 11.628 -8.118 -3.111
183 2HD PRO 21 1HD PRO 21 11.228 -6.574 -3.898
184 H GLY 22 H GLY 22 9.417 -7.665 0.042
185 1HA GLY 22 2HA GLY 22 9.416 -10.500 0.884
186 2HA GLY 22 1HA GLY 22 10.636 -9.358 1.431
187 H LYS 23 H LYS 23 7.550 -10.659 1.988
188 HA LYS 23 HA LYS 23 7.212 -8.865 4.287
189 1HB LYS 23 2HB LYS 23 4.870 -8.657 3.952
190 2HB LYS 23 1HB LYS 23 5.598 -8.321 2.389
191 1HG LYS 23 2HG LYS 23 4.439 -10.993 3.160
192 2HG LYS 23 1HG LYS 23 3.538 -9.733 2.320
193 1HD LYS 23 2HD LYS 23 5.025 -9.850 0.435
194 2HD LYS 23 1HD LYS 23 6.103 -10.948 1.298
195 1HE LYS 23 2HE LYS 23 4.786 -12.224 -0.253
196 2HE LYS 23 1HE LYS 23 4.262 -12.610 1.383
197 1HZ LYS 23 1HZ LYS 23 2.351 -12.347 0.014
198 2HZ LYS 23 2HZ LYS 23 2.880 -10.842 -0.563
199 3HZ LYS 23 3HZ LYS 23 2.414 -11.012 1.054
200 H PHE 24 H PHE 24 6.031 -9.873 6.078
201 HA PHE 24 HA PHE 24 6.533 -12.725 6.205
202 1HB PHE 24 2HB PHE 24 7.050 -11.172 8.113
203 2HB PHE 24 1HB PHE 24 5.318 -10.934 8.318
204 HD1 PHE 24 1HD PHE 24 4.057 -12.411 9.608
205 HD2 PHE 24 2HD PHE 24 7.962 -13.532 8.346
206 HE1 PHE 24 1HE PHE 24 3.954 -14.391 11.063
207 HE2 PHE 24 2HE PHE 24 7.868 -15.517 9.799
208 HZ PHE 24 HZ PHE 24 5.860 -15.946 11.161
209 H THR 25 H THR 25 3.716 -10.764 7.162
210 HA THR 25 HA THR 25 1.939 -12.335 5.524
211 HB THR 25 HB THR 25 2.200 -13.728 7.591
212 HG1 THR 25 1HG THR 25 0.059 -14.175 7.695
213 1HG2 THR 25 1HG2 THR 25 0.873 -11.392 8.977
214 2HG2 THR 25 2HG2 THR 25 2.537 -11.925 9.220
215 3HG2 THR 25 3HG2 THR 25 1.197 -12.970 9.688
216 H ASP 26 H ASP 26 -0.475 -11.564 6.721
217 HA ASP 26 HA ASP 26 -0.507 -8.746 6.118
218 1HB ASP 26 2HB ASP 26 -2.936 -8.879 6.507
219 2HB ASP 26 1HB ASP 26 -2.386 -10.113 5.385
220 H ASP 27 H ASP 27 1.077 -8.367 7.835
221 HA ASP 27 HA ASP 27 -0.115 -8.167 10.521
222 1HB ASP 27 2HB ASP 27 1.563 -9.776 10.722
223 2HB ASP 27 1HB ASP 27 2.617 -8.959 9.574
224 H PHE 28 H PHE 28 0.289 -6.303 11.724
225 HA PHE 28 HA PHE 28 0.425 -3.956 10.093
226 1HB PHE 28 2HB PHE 28 0.251 -4.178 13.106
227 2HB PHE 28 1HB PHE 28 -0.079 -2.737 12.147
228 HD1 PHE 28 1HD PHE 28 -2.004 -2.816 10.497
229 HD2 PHE 28 2HD PHE 28 -1.426 -5.746 13.530
230 HE1 PHE 28 1HE PHE 28 -4.358 -3.503 10.279
231 HE2 PHE 28 2HE PHE 28 -3.777 -6.437 13.318
232 HZ PHE 28 HZ PHE 28 -5.244 -5.316 11.688
233 H ASP 29 H ASP 29 2.582 -5.499 12.409
234 HA ASP 29 HA ASP 29 4.492 -3.413 12.542
235 1HB ASP 29 2HB ASP 29 4.507 -5.218 14.169
236 2HB ASP 29 1HB ASP 29 4.802 -6.404 12.904
237 H THR 30 H THR 30 3.974 -6.101 10.375
238 HA THR 30 HA THR 30 6.301 -5.912 8.834
239 HB THR 30 HB THR 30 3.540 -6.837 8.015
240 HG1 THR 30 1HG THR 30 4.514 -8.008 9.763
241 1HG2 THR 30 1HG2 THR 30 4.687 -8.077 6.230
242 2HG2 THR 30 2HG2 THR 30 6.218 -7.330 6.697
243 3HG2 THR 30 3HG2 THR 30 4.911 -6.335 6.050
244 H ASN 31 H ASN 31 3.038 -4.559 8.074
245 HA ASN 31 HA ASN 31 3.973 -3.224 5.765
246 1HB ASN 31 2HB ASN 31 1.854 -2.121 5.651
247 2HB ASN 31 1HB ASN 31 1.562 -3.759 6.224
248 1HD2 ASN 31 1HD2 ASN 31 1.614 -0.383 7.100
249 2HD2 ASN 31 2HD2 ASN 31 0.715 -0.556 8.565
250 H LYS 32 H LYS 32 3.889 -2.307 9.131
251 HA LYS 32 HA LYS 32 4.363 0.430 8.932
252 1HB LYS 32 2HB LYS 32 3.979 -0.671 11.075
253 2HB LYS 32 1HB LYS 32 5.484 -1.564 10.915
254 1HG LYS 32 2HG LYS 32 6.638 0.704 10.864
255 2HG LYS 32 1HG LYS 32 5.101 1.370 11.413
256 1HD LYS 32 2HD LYS 32 6.621 0.935 13.287
257 2HD LYS 32 1HD LYS 32 5.166 -0.058 13.383
258 1HE LYS 32 2HE LYS 32 6.334 -1.988 12.617
259 2HE LYS 32 1HE LYS 32 7.752 -1.032 12.181
260 1HZ LYS 32 1HZ LYS 32 8.206 -0.625 14.468
261 2HZ LYS 32 2HZ LYS 32 7.963 -2.294 14.291
262 3HZ LYS 32 3HZ LYS 32 6.745 -1.329 14.960
263 H LYS 33 H LYS 33 6.729 -2.220 9.102
264 HA LYS 33 HA LYS 33 8.964 -0.532 8.621
265 1HB LYS 33 2HB LYS 33 8.662 -3.533 8.435
266 2HB LYS 33 1HB LYS 33 10.195 -2.676 8.315
267 1HG LYS 33 2HG LYS 33 9.878 -1.801 10.574
268 2HG LYS 33 1HG LYS 33 8.358 -2.686 10.699
269 1HD LYS 33 2HD LYS 33 11.050 -3.954 10.224
270 2HD LYS 33 1HD LYS 33 10.266 -3.827 11.798
271 1HE LYS 33 2HE LYS 33 8.350 -5.114 10.888
272 2HE LYS 33 1HE LYS 33 9.242 -5.313 9.381
273 1HZ LYS 33 1HZ LYS 33 9.434 -7.232 10.882
274 2HZ LYS 33 2HZ LYS 33 10.198 -6.246 12.031
275 3HZ LYS 33 3HZ LYS 33 10.937 -6.529 10.530
276 H LEU 34 H LEU 34 6.752 -2.287 6.584
277 HA LEU 34 HA LEU 34 8.280 -2.257 4.212
278 1HB LEU 34 2HB LEU 34 5.290 -2.275 4.625
279 2HB LEU 34 1HB LEU 34 6.056 -2.451 3.060
280 HG LEU 34 HG LEU 34 6.299 -4.352 5.393
281 1HD1 LEU 34 1HD1 LEU 34 4.992 -4.654 2.696
282 2HD1 LEU 34 2HD1 LEU 34 4.158 -4.463 4.238
283 3HD1 LEU 34 3HD1 LEU 34 5.123 -5.908 3.930
284 1HD2 LEU 34 1HD2 LEU 34 8.402 -4.235 4.161
285 2HD2 LEU 34 2HD2 LEU 34 7.539 -4.509 2.646
286 3HD2 LEU 34 3HD2 LEU 34 7.587 -5.773 3.877
287 H VAL 35 H VAL 35 5.770 -0.001 5.396
288 HA VAL 35 HA VAL 35 5.941 1.823 3.261
289 HB VAL 35 HB VAL 35 5.221 2.401 6.150
290 1HG1 VAL 35 1HG1 VAL 35 5.726 4.443 4.922
291 2HG1 VAL 35 2HG1 VAL 35 3.998 4.330 5.253
292 3HG1 VAL 35 3HG1 VAL 35 4.612 3.967 3.640
293 1HG2 VAL 35 1HG2 VAL 35 2.909 2.129 5.436
294 2HG2 VAL 35 2HG2 VAL 35 3.829 0.648 5.167
295 3HG2 VAL 35 3HG2 VAL 35 3.445 1.709 3.810
296 H GLU 36 H GLU 36 7.835 1.463 6.193
297 HA GLU 36 HA GLU 36 9.240 3.877 6.156
298 1HB GLU 36 2HB GLU 36 9.230 2.176 7.988
299 2HB GLU 36 1HB GLU 36 10.285 1.175 7.005
300 1HG GLU 36 2HG GLU 36 12.016 2.854 7.087
301 2HG GLU 36 1HG GLU 36 10.949 3.939 7.982
302 H GLU 37 H GLU 37 9.809 0.842 4.428
303 HA GLU 37 HA GLU 37 12.174 1.845 3.105
304 1HB GLU 37 2HB GLU 37 10.495 -0.608 2.563
305 2HB GLU 37 1HB GLU 37 12.011 -0.232 1.759
306 1HG GLU 37 2HG GLU 37 13.130 -0.311 3.976
307 2HG GLU 37 1HG GLU 37 11.604 -0.856 4.672
308 H PHE 38 H PHE 38 8.866 1.022 2.143
309 HA PHE 38 HA PHE 38 9.198 1.735 -0.574
310 1HB PHE 38 2HB PHE 38 6.627 1.488 1.000
311 2HB PHE 38 1HB PHE 38 6.780 1.455 -0.749
312 HD1 PHE 38 1HD PHE 38 5.444 -0.635 0.964
313 HD2 PHE 38 2HD PHE 38 9.427 -0.300 -0.505
314 HE1 PHE 38 1HE PHE 38 5.679 -3.081 1.046
315 HE2 PHE 38 2HE PHE 38 9.662 -2.744 -0.427
316 HZ PHE 38 HZ PHE 38 7.793 -4.138 0.348
317 H SER 39 H SER 39 9.660 3.751 -1.163
318 HA SER 39 HA SER 39 7.890 5.875 -0.276
319 1HB SER 39 2HB SER 39 10.104 7.293 0.013
320 2HB SER 39 1HB SER 39 9.473 6.317 1.337
321 HG SER 39 HG SER 39 10.913 4.624 0.556
322 H THR 40 H THR 40 7.076 6.148 -2.277
323 HA THR 40 HA THR 40 8.899 6.995 -4.407
324 HB THR 40 HB THR 40 5.951 6.306 -4.463
325 HG1 THR 40 1HG THR 40 8.228 5.065 -5.656
326 1HG2 THR 40 1HG2 THR 40 6.404 8.100 -6.063
327 2HG2 THR 40 2HG2 THR 40 6.082 6.582 -6.898
328 3HG2 THR 40 3HG2 THR 40 7.737 7.173 -6.744
329 H VAL 41 H VAL 41 6.103 8.009 -2.533
330 HA VAL 41 HA VAL 41 6.915 10.796 -2.879
331 HB VAL 41 HB VAL 41 4.529 11.496 -2.939
332 1HG1 VAL 41 1HG1 VAL 41 4.120 10.975 -5.284
333 2HG1 VAL 41 2HG1 VAL 41 5.341 9.702 -5.219
334 3HG1 VAL 41 3HG1 VAL 41 5.811 11.389 -5.004
335 1HG2 VAL 41 1HG2 VAL 41 3.982 8.555 -3.359
336 2HG2 VAL 41 2HG2 VAL 41 2.802 9.854 -3.539
337 3HG2 VAL 41 3HG2 VAL 41 3.508 9.519 -1.959
338 H SER 42 H SER 42 6.211 12.153 -1.090
339 HA SER 42 HA SER 42 6.417 10.740 1.391
340 1HB SER 42 2HB SER 42 7.472 12.969 0.964
341 2HB SER 42 1HB SER 42 5.859 13.682 0.949
342 HG SER 42 HG SER 42 7.105 12.328 3.117
343 H THR 43 H THR 43 4.653 9.535 1.832
344 HA THR 43 HA THR 43 1.984 10.522 1.547
345 HB THR 43 HB THR 43 1.469 8.388 2.914
346 HG1 THR 43 1HG THR 43 3.606 7.029 2.308
347 1HG2 THR 43 1HG2 THR 43 1.833 6.953 0.946
348 2HG2 THR 43 2HG2 THR 43 2.864 8.201 0.241
349 3HG2 THR 43 3HG2 THR 43 1.149 8.518 0.507
350 H LYS 44 H LYS 44 1.234 12.041 2.846
351 HA LYS 44 HA LYS 44 2.398 12.450 5.461
352 1HB LYS 44 2HB LYS 44 1.918 14.328 3.886
353 2HB LYS 44 1HB LYS 44 0.201 14.001 4.083
354 1HG LYS 44 2HG LYS 44 0.856 15.863 5.461
355 2HG LYS 44 1HG LYS 44 0.407 14.497 6.481
356 1HD LYS 44 2HD LYS 44 2.791 13.943 6.751
357 2HD LYS 44 1HD LYS 44 3.212 15.349 5.768
358 1HE LYS 44 2HE LYS 44 2.169 16.820 7.396
359 2HE LYS 44 1HE LYS 44 1.687 15.429 8.368
360 1HZ LYS 44 1HZ LYS 44 4.444 16.383 7.833
361 2HZ LYS 44 2HZ LYS 44 4.096 14.894 8.568
362 3HZ LYS 44 3HZ LYS 44 3.632 16.340 9.320
363 H HIS 45 H HIS 45 -1.025 12.683 4.524
364 HA HIS 45 HA HIS 45 -1.698 11.393 7.080
365 1HB HIS 45 2HB HIS 45 -2.573 13.740 6.219
366 2HB HIS 45 1HB HIS 45 -3.729 12.743 5.347
367 HD1 HIS 45 1HD HIS 45 -3.145 14.313 8.554
368 HD2 HIS 45 2HD HIS 45 -5.296 11.027 7.177
369 HE1 HIS 45 1HE HIS 45 -4.792 13.763 10.374
370 HE2 HIS 45 2HE HIS 45 -5.918 11.646 9.613
371 H LEU 46 H LEU 46 -1.929 11.124 3.648
372 HA LEU 46 HA LEU 46 -3.895 9.093 3.482
373 1HB LEU 46 2HB LEU 46 -2.542 10.658 1.700
374 2HB LEU 46 1HB LEU 46 -1.754 9.118 1.448
375 HG LEU 46 HG LEU 46 -3.603 9.544 -0.137
376 1HD1 LEU 46 1HD1 LEU 46 -4.703 7.386 0.079
377 2HD1 LEU 46 2HD1 LEU 46 -4.083 7.230 1.724
378 3HD1 LEU 46 3HD1 LEU 46 -2.966 7.254 0.358
379 1HD2 LEU 46 1HD2 LEU 46 -5.915 9.406 0.657
380 2HD2 LEU 46 2HD2 LEU 46 -5.076 10.809 1.319
381 3HD2 LEU 46 3HD2 LEU 46 -5.337 9.384 2.323
382 H ARG 47 H ARG 47 -0.731 9.069 4.667
383 HA ARG 47 HA ARG 47 0.268 6.604 3.813
384 1HB ARG 47 2HB ARG 47 1.588 8.374 4.948
385 2HB ARG 47 1HB ARG 47 0.791 7.962 6.463
386 1HG ARG 47 2HG ARG 47 1.787 5.797 6.483
387 2HG ARG 47 1HG ARG 47 2.413 6.005 4.847
388 1HD ARG 47 2HD ARG 47 4.215 6.334 6.372
389 2HD ARG 47 1HD ARG 47 3.787 7.900 5.689
390 HE ARG 47 HE ARG 47 2.752 7.096 8.329
391 1HH1 ARG 47 1HH1 ARG 47 4.565 9.285 6.292
392 2HH1 ARG 47 2HH1 ARG 47 4.882 10.423 7.561
393 1HH2 ARG 47 1HH2 ARG 47 3.161 8.582 10.012
394 2HH2 ARG 47 2HH2 ARG 47 4.060 10.034 9.687
395 H ASN 48 H ASN 48 -1.929 7.412 6.424
396 HA ASN 48 HA ASN 48 -1.851 4.937 7.765
397 1HB ASN 48 2HB ASN 48 -4.137 6.911 7.569
398 2HB ASN 48 1HB ASN 48 -4.005 5.615 8.752
399 1HD2 ASN 48 1HD2 ASN 48 -2.461 5.784 10.407
400 2HD2 ASN 48 2HD2 ASN 48 -1.756 7.312 10.829
401 H LYS 49 H LYS 49 -3.934 6.155 5.166
402 HA LYS 49 HA LYS 49 -5.482 3.804 4.908
403 1HB LYS 49 2HB LYS 49 -4.917 6.078 3.016
404 2HB LYS 49 1HB LYS 49 -5.932 4.716 2.561
405 1HG LYS 49 2HG LYS 49 -7.412 5.223 4.464
406 2HG LYS 49 1HG LYS 49 -6.425 6.642 4.821
407 1HD LYS 49 2HD LYS 49 -6.970 7.625 2.696
408 2HD LYS 49 1HD LYS 49 -7.792 6.153 2.180
409 1HE LYS 49 2HE LYS 49 -9.423 7.815 2.827
410 2HE LYS 49 1HE LYS 49 -9.447 6.480 3.977
411 1HZ LYS 49 1HZ LYS 49 -8.203 7.791 5.533
412 2HZ LYS 49 2HZ LYS 49 -9.551 8.688 5.024
413 3HZ LYS 49 3HZ LYS 49 -8.014 9.047 4.408
414 H ILE 50 H ILE 50 -2.559 4.952 3.267
415 HA ILE 50 HA ILE 50 -2.245 2.868 1.429
416 HB ILE 50 HB ILE 50 -0.124 4.500 2.841
417 1HG1 ILE 50 2HG1 ILE 50 -1.681 5.832 1.491
418 2HG1 ILE 50 1HG1 ILE 50 -0.086 5.803 0.750
419 1HG2 ILE 50 1HG2 ILE 50 0.131 2.713 0.428
420 2HG2 ILE 50 2HG2 ILE 50 0.867 2.458 2.009
421 3HG2 ILE 50 3HG2 ILE 50 1.377 3.818 1.007
422 1HD1 ILE 50 1HD1 ILE 50 -2.473 4.169 -0.085
423 2HD1 ILE 50 2HD1 ILE 50 -0.869 4.085 -0.816
424 3HD1 ILE 50 3HD1 ILE 50 -1.811 5.574 -0.924
425 H ALA 51 H ALA 51 -1.050 3.172 4.755
426 HA ALA 51 HA ALA 51 0.329 0.755 4.938
427 1HB ALA 51 1HB ALA 51 0.478 2.520 6.623
428 2HB ALA 51 2HB ALA 51 0.050 0.977 7.360
429 3HB ALA 51 3HB ALA 51 -1.188 2.208 7.109
430 H GLY 52 H GLY 52 -3.068 1.483 5.703
431 1HA GLY 52 2HA GLY 52 -3.789 -1.138 6.465
432 2HA GLY 52 1HA GLY 52 -4.899 0.114 5.931
433 H TYR 53 H TYR 53 -3.715 0.463 3.326
434 HA TYR 53 HA TYR 53 -5.071 -1.639 1.960
435 1HB TYR 53 2HB TYR 53 -3.646 0.834 1.170
436 2HB TYR 53 1HB TYR 53 -3.735 -0.441 -0.043
437 HD1 TYR 53 1HD TYR 53 -5.663 1.985 1.914
438 HD2 TYR 53 2HD TYR 53 -5.858 -1.126 -0.983
439 HE1 TYR 53 1HE TYR 53 -7.962 2.660 1.353
440 HE2 TYR 53 2HE TYR 53 -8.154 -0.460 -1.554
441 HH TYR 53 HH TYR 53 -9.546 2.467 -0.511
442 H ILE 54 H ILE 54 -1.688 -0.972 2.679
443 HA ILE 54 HA ILE 54 -0.547 -2.904 0.998
444 HB ILE 54 HB ILE 54 0.405 -1.887 3.678
445 1HG1 ILE 54 2HG1 ILE 54 1.224 -1.263 0.827
446 2HG1 ILE 54 1HG1 ILE 54 0.305 -0.208 1.899
447 1HG2 ILE 54 1HG2 ILE 54 2.608 -2.841 3.058
448 2HG2 ILE 54 2HG2 ILE 54 1.846 -3.637 1.681
449 3HG2 ILE 54 3HG2 ILE 54 1.376 -4.077 3.321
450 1HD1 ILE 54 1HD1 ILE 54 3.150 -1.103 2.291
451 2HD1 ILE 54 2HD1 ILE 54 2.238 -0.075 3.396
452 3HD1 ILE 54 3HD1 ILE 54 2.614 0.494 1.768
453 H THR 55 H THR 55 -1.572 -3.216 4.422
454 HA THR 55 HA THR 55 -1.148 -5.967 4.622
455 HB THR 55 HB THR 55 -3.173 -5.748 6.313
456 HG1 THR 55 1HG THR 55 -3.686 -3.589 5.460
457 1HG2 THR 55 1HG2 THR 55 -0.484 -4.436 6.701
458 2HG2 THR 55 2HG2 THR 55 -0.872 -6.135 6.973
459 3HG2 THR 55 3HG2 THR 55 -1.587 -4.890 7.997
460 H ARG 56 H ARG 56 -3.817 -4.179 3.195
461 HA ARG 56 HA ARG 56 -5.540 -6.424 2.893
462 1HB ARG 56 2HB ARG 56 -5.451 -3.734 1.537
463 2HB ARG 56 1HB ARG 56 -6.635 -4.963 1.110
464 1HG ARG 56 2HG ARG 56 -7.454 -4.972 3.420
465 2HG ARG 56 1HG ARG 56 -6.288 -3.712 3.831
466 1HD ARG 56 2HD ARG 56 -7.335 -2.192 2.266
467 2HD ARG 56 1HD ARG 56 -8.444 -3.457 1.739
468 HE ARG 56 HE ARG 56 -9.019 -3.359 4.329
469 1HH1 ARG 56 1HH1 ARG 56 -8.579 -0.769 2.023
470 2HH1 ARG 56 2HH1 ARG 56 -9.651 0.329 2.839
471 1HH2 ARG 56 1HH2 ARG 56 -10.437 -1.919 5.420
472 2HH2 ARG 56 2HH2 ARG 56 -10.706 -0.329 4.767
473 H ILE 57 H ILE 57 -3.103 -4.912 0.811
474 HA ILE 57 HA ILE 57 -3.517 -6.560 -1.443
475 HB ILE 57 HB ILE 57 -0.990 -5.174 -0.518
476 1HG1 ILE 57 2HG1 ILE 57 -3.039 -4.387 -2.607
477 2HG1 ILE 57 1HG1 ILE 57 -2.912 -3.682 -0.998
478 1HG2 ILE 57 1HG2 ILE 57 -0.208 -5.442 -2.832
479 2HG2 ILE 57 2HG2 ILE 57 -1.636 -6.412 -3.195
480 3HG2 ILE 57 3HG2 ILE 57 -0.445 -6.997 -2.033
481 1HD1 ILE 57 1HD1 ILE 57 -0.688 -2.835 -1.551
482 2HD1 ILE 57 2HD1 ILE 57 -1.910 -2.244 -2.676
483 3HD1 ILE 57 3HD1 ILE 57 -0.821 -3.545 -3.160
484 H ILE 58 H ILE 58 -1.305 -6.864 1.322
485 HA ILE 58 HA ILE 58 -0.173 -9.331 0.580
486 HB ILE 58 HB ILE 58 -0.662 -8.296 3.379
487 1HG1 ILE 58 2HG1 ILE 58 1.781 -8.031 1.613
488 2HG1 ILE 58 1HG1 ILE 58 0.636 -6.736 1.954
489 1HG2 ILE 58 1HG2 ILE 58 1.149 -9.780 4.038
490 2HG2 ILE 58 2HG2 ILE 58 1.301 -10.352 2.378
491 3HG2 ILE 58 3HG2 ILE 58 -0.166 -10.692 3.297
492 1HD1 ILE 58 1HD1 ILE 58 1.232 -6.864 4.329
493 2HD1 ILE 58 2HD1 ILE 58 2.629 -6.513 3.309
494 3HD1 ILE 58 3HD1 ILE 58 2.396 -8.136 3.956
495 H SER 59 H SER 59 -3.089 -8.509 2.368
496 HA SER 59 HA SER 59 -3.843 -11.119 3.104
497 1HB SER 59 2HB SER 59 -4.781 -9.029 4.092
498 2HB SER 59 1HB SER 59 -5.640 -8.737 2.582
499 HG SER 59 HG SER 59 -6.029 -10.807 4.476
500 H GLN 60 H GLN 60 -4.272 -9.272 0.163
501 HA GLN 60 HA GLN 60 -6.124 -11.066 -1.073
502 1HB GLN 60 2HB GLN 60 -5.933 -8.724 -1.769
503 2HB GLN 60 1HB GLN 60 -4.272 -8.994 -2.276
504 1HG GLN 60 2HG GLN 60 -5.048 -10.538 -4.001
505 2HG GLN 60 1HG GLN 60 -6.715 -10.281 -3.482
506 1HE2 GLN 60 1HE2 GLN 60 -5.455 -9.768 -6.074
507 2HE2 GLN 60 2HE2 GLN 60 -5.694 -8.079 -6.395
508 H GLN 61 H GLN 61 -2.642 -10.748 -0.944
509 HA GLN 61 HA GLN 61 -2.138 -12.843 -2.865
510 1HB GLN 61 2HB GLN 61 -0.280 -11.513 -0.881
511 2HB GLN 61 1HB GLN 61 0.215 -12.584 -2.183
512 1HG GLN 61 2HG GLN 61 -0.499 -10.994 -3.831
513 2HG GLN 61 1HG GLN 61 -1.176 -9.949 -2.581
514 1HE2 GLN 61 1HE2 GLN 61 0.904 -9.409 -4.570
515 2HE2 GLN 61 2HE2 GLN 61 2.300 -8.919 -3.677
516 H LYS 62 H LYS 62 -3.213 -12.825 0.261
517 HA LYS 62 HA LYS 62 -1.615 -14.950 1.336
518 1HB LYS 62 2HB LYS 62 -2.754 -13.088 2.654
519 2HB LYS 62 1HB LYS 62 -4.263 -13.945 2.382
520 1HG LYS 62 2HG LYS 62 -3.458 -15.852 3.613
521 2HG LYS 62 1HG LYS 62 -1.865 -15.115 3.781
522 1HD LYS 62 2HD LYS 62 -2.925 -13.243 5.024
523 2HD LYS 62 1HD LYS 62 -4.456 -14.117 4.959
524 1HE LYS 62 2HE LYS 62 -3.439 -15.968 6.190
525 2HE LYS 62 1HE LYS 62 -1.911 -15.093 6.252
526 1HZ LYS 62 1HZ LYS 62 -3.028 -13.331 7.494
527 2HZ LYS 62 2HZ LYS 62 -3.119 -14.815 8.312
528 3HZ LYS 62 3HZ LYS 62 -4.472 -14.224 7.477
Start of MODEL 8
1 1H MET 1 1HT MET 1 -16.086 10.770 -4.512
2 2H MET 1 2HT MET 1 -16.049 11.338 -6.108
3 3H MET 1 3HT MET 1 -17.353 11.733 -5.101
4 HA MET 1 HA MET 1 -15.909 13.622 -5.294
5 1HB MET 1 2HB MET 1 -15.662 12.235 -2.614
6 2HB MET 1 1HB MET 1 -15.330 13.938 -2.895
7 1HG MET 1 2HG MET 1 -17.642 14.323 -3.489
8 2HG MET 1 1HG MET 1 -17.997 12.606 -3.315
9 1HE MET 1 1HE MET 1 -20.023 13.236 -1.695
10 2HE MET 1 2HE MET 1 -19.638 14.951 -1.845
11 3HE MET 1 3HE MET 1 -19.848 14.229 -0.249
12 H GLY 2 H GLY 2 -13.811 14.574 -4.845
13 1HA GLY 2 2HA GLY 2 -11.524 14.659 -4.804
14 2HA GLY 2 1HA GLY 2 -11.559 13.078 -4.042
15 H ASN 3 H ASN 3 -13.025 13.517 -7.167
16 HA ASN 3 HA ASN 3 -12.553 12.656 -9.224
17 1HB ASN 3 2HB ASN 3 -9.749 13.282 -8.290
18 2HB ASN 3 1HB ASN 3 -10.094 12.662 -9.901
19 1HD2 ASN 3 1HD2 ASN 3 -9.279 14.541 -10.839
20 2HD2 ASN 3 2HD2 ASN 3 -10.164 16.032 -10.821
21 H ILE 4 H ILE 4 -12.581 10.949 -6.760
22 HA ILE 4 HA ILE 4 -12.189 8.863 -6.009
23 HB ILE 4 HB ILE 4 -12.660 7.033 -7.529
24 1HG1 ILE 4 2HG1 ILE 4 -12.653 9.082 -9.752
25 2HG1 ILE 4 1HG1 ILE 4 -11.407 7.865 -9.505
26 1HG2 ILE 4 1HG2 ILE 4 -14.497 8.292 -6.614
27 2HG2 ILE 4 2HG2 ILE 4 -14.881 7.774 -8.255
28 3HG2 ILE 4 3HG2 ILE 4 -14.407 9.444 -7.947
29 1HD1 ILE 4 1HD1 ILE 4 -12.937 7.191 -11.251
30 2HD1 ILE 4 2HD1 ILE 4 -14.302 7.334 -10.141
31 3HD1 ILE 4 3HD1 ILE 4 -13.065 6.106 -9.867
32 H ARG 5 H ARG 5 -9.702 10.314 -6.786
33 HA ARG 5 HA ARG 5 -7.950 8.211 -7.640
34 1HB ARG 5 2HB ARG 5 -6.108 9.776 -6.840
35 2HB ARG 5 1HB ARG 5 -7.105 10.330 -8.173
36 1HG ARG 5 2HG ARG 5 -8.289 11.837 -6.763
37 2HG ARG 5 1HG ARG 5 -7.541 11.149 -5.317
38 1HD ARG 5 2HD ARG 5 -5.592 12.260 -5.631
39 2HD ARG 5 1HD ARG 5 -5.682 12.131 -7.385
40 HE ARG 5 HE ARG 5 -7.392 13.957 -7.231
41 1HH1 ARG 5 1HH1 ARG 5 -4.908 13.589 -4.783
42 2HH1 ARG 5 2HH1 ARG 5 -4.888 15.271 -4.372
43 1HH2 ARG 5 1HH2 ARG 5 -7.347 16.171 -6.709
44 2HH2 ARG 5 2HH2 ARG 5 -6.255 16.754 -5.489
45 H THR 6 H THR 6 -8.068 6.520 -6.419
46 HA THR 6 HA THR 6 -6.810 6.522 -3.827
47 HB THR 6 HB THR 6 -9.708 5.636 -4.037
48 HG1 THR 6 1HG THR 6 -8.709 8.032 -3.513
49 1HG2 THR 6 1HG2 THR 6 -8.410 4.183 -2.568
50 2HG2 THR 6 2HG2 THR 6 -9.517 5.185 -1.629
51 3HG2 THR 6 3HG2 THR 6 -7.800 5.590 -1.695
52 H SER 7 H SER 7 -8.458 4.880 -6.463
53 HA SER 7 HA SER 7 -7.510 2.285 -6.031
54 1HB SER 7 2HB SER 7 -7.637 3.536 -8.767
55 2HB SER 7 1HB SER 7 -8.106 1.907 -8.272
56 HG SER 7 HG SER 7 -10.048 2.698 -8.119
57 H PHE 8 H PHE 8 -5.958 5.213 -6.970
58 HA PHE 8 HA PHE 8 -3.574 4.115 -8.039
59 1HB PHE 8 2HB PHE 8 -4.275 6.834 -6.947
60 2HB PHE 8 1HB PHE 8 -2.665 6.446 -7.548
61 HD1 PHE 8 1HD PHE 8 -6.163 7.014 -8.464
62 HD2 PHE 8 2HD PHE 8 -2.265 6.082 -9.899
63 HE1 PHE 8 1HE PHE 8 -6.894 7.505 -10.763
64 HE2 PHE 8 2HE PHE 8 -2.988 6.573 -12.197
65 HZ PHE 8 HZ PHE 8 -5.305 7.285 -12.632
66 H VAL 9 H VAL 9 -4.779 4.301 -4.861
67 HA VAL 9 HA VAL 9 -2.292 4.372 -3.481
68 HB VAL 9 HB VAL 9 -4.942 3.176 -2.636
69 1HG1 VAL 9 1HG1 VAL 9 -2.507 3.790 -0.969
70 2HG1 VAL 9 2HG1 VAL 9 -3.066 2.176 -1.412
71 3HG1 VAL 9 3HG1 VAL 9 -4.057 3.199 -0.370
72 1HG2 VAL 9 1HG2 VAL 9 -5.017 5.599 -3.014
73 2HG2 VAL 9 2HG2 VAL 9 -3.641 5.809 -1.934
74 3HG2 VAL 9 3HG2 VAL 9 -5.176 5.216 -1.299
75 H LYS 10 H LYS 10 -4.324 1.806 -4.805
76 HA LYS 10 HA LYS 10 -2.666 -0.369 -4.079
77 1HB LYS 10 2HB LYS 10 -5.000 -0.642 -4.829
78 2HB LYS 10 1HB LYS 10 -4.554 -0.077 -6.432
79 1HG LYS 10 2HG LYS 10 -3.118 -2.025 -6.733
80 2HG LYS 10 1HG LYS 10 -3.535 -2.583 -5.110
81 1HD LYS 10 2HD LYS 10 -5.877 -2.769 -5.762
82 2HD LYS 10 1HD LYS 10 -5.488 -2.177 -7.378
83 1HE LYS 10 2HE LYS 10 -4.394 -4.700 -6.139
84 2HE LYS 10 1HE LYS 10 -5.735 -4.633 -7.280
85 1HZ LYS 10 1HZ LYS 10 -2.910 -3.887 -7.789
86 2HZ LYS 10 2HZ LYS 10 -4.174 -3.567 -8.872
87 3HZ LYS 10 3HZ LYS 10 -3.777 -5.170 -8.480
88 H ARG 11 H ARG 11 -2.820 1.753 -6.878
89 HA ARG 11 HA ARG 11 -0.783 0.701 -8.450
90 1HB ARG 11 2HB ARG 11 -2.094 2.421 -9.377
91 2HB ARG 11 1HB ARG 11 -1.833 3.485 -8.008
92 1HG ARG 11 2HG ARG 11 -0.644 4.368 -9.859
93 2HG ARG 11 1HG ARG 11 0.542 3.717 -8.730
94 1HD ARG 11 2HD ARG 11 0.992 1.867 -10.104
95 2HD ARG 11 1HD ARG 11 -0.472 2.114 -11.059
96 HE ARG 11 HE ARG 11 0.809 4.350 -11.608
97 1HH1 ARG 11 1HH1 ARG 11 2.171 1.143 -11.348
98 2HH1 ARG 11 2HH1 ARG 11 3.335 1.402 -12.616
99 1HH2 ARG 11 1HH2 ARG 11 2.346 4.713 -13.240
100 2HH2 ARG 11 2HH2 ARG 11 3.429 3.430 -13.698
101 H ILE 12 H ILE 12 -0.529 3.182 -5.898
102 HA ILE 12 HA ILE 12 2.278 3.419 -6.052
103 HB ILE 12 HB ILE 12 0.408 4.087 -3.778
104 1HG1 ILE 12 2HG1 ILE 12 -0.066 5.355 -5.796
105 2HG1 ILE 12 1HG1 ILE 12 0.685 6.408 -4.598
106 1HG2 ILE 12 1HG2 ILE 12 2.687 3.790 -2.947
107 2HG2 ILE 12 2HG2 ILE 12 2.206 5.485 -2.891
108 3HG2 ILE 12 3HG2 ILE 12 3.284 4.917 -4.166
109 1HD1 ILE 12 1HD1 ILE 12 2.815 6.222 -5.767
110 2HD1 ILE 12 2HD1 ILE 12 1.548 6.835 -6.830
111 3HD1 ILE 12 3HD1 ILE 12 2.074 5.155 -6.959
112 H ALA 13 H ALA 13 0.183 1.506 -3.907
113 HA ALA 13 HA ALA 13 2.205 0.478 -2.258
114 1HB ALA 13 1HB ALA 13 0.599 -1.223 -1.605
115 2HB ALA 13 2HB ALA 13 -0.405 -0.840 -3.004
116 3HB ALA 13 3HB ALA 13 -0.188 0.350 -1.720
117 H LYS 14 H LYS 14 0.834 -0.754 -5.280
118 HA LYS 14 HA LYS 14 2.224 -3.186 -5.373
119 1HB LYS 14 2HB LYS 14 0.382 -2.866 -6.847
120 2HB LYS 14 1HB LYS 14 1.094 -1.414 -7.535
121 1HG LYS 14 2HG LYS 14 2.810 -2.717 -8.617
122 2HG LYS 14 1HG LYS 14 2.217 -4.192 -7.850
123 1HD LYS 14 2HD LYS 14 0.192 -4.121 -9.086
124 2HD LYS 14 1HD LYS 14 0.523 -2.484 -9.656
125 1HE LYS 14 2HE LYS 14 2.269 -4.845 -10.318
126 2HE LYS 14 1HE LYS 14 0.919 -4.334 -11.329
127 1HZ LYS 14 1HZ LYS 14 3.100 -2.469 -10.571
128 2HZ LYS 14 2HZ LYS 14 1.968 -2.317 -11.830
129 3HZ LYS 14 3HZ LYS 14 3.206 -3.469 -11.937
130 H GLU 15 H GLU 15 3.037 -0.045 -6.842
131 HA GLU 15 HA GLU 15 5.538 -0.951 -7.851
132 1HB GLU 15 2HB GLU 15 4.125 1.654 -7.664
133 2HB GLU 15 1HB GLU 15 5.865 1.692 -7.914
134 1HG GLU 15 2HG GLU 15 4.433 1.771 -9.984
135 2HG GLU 15 1HG GLU 15 5.707 0.556 -9.963
136 H MET 16 H MET 16 4.523 0.282 -4.793
137 HA MET 16 HA MET 16 7.048 1.154 -3.835
138 1HB MET 16 2HB MET 16 4.941 1.810 -2.765
139 2HB MET 16 1HB MET 16 4.631 0.137 -2.323
140 1HG MET 16 2HG MET 16 6.617 0.156 -0.892
141 2HG MET 16 1HG MET 16 6.906 1.839 -1.326
142 1HE MET 16 1HE MET 16 3.911 2.936 -1.441
143 2HE MET 16 2HE MET 16 5.217 3.837 -0.671
144 3HE MET 16 3HE MET 16 3.701 3.568 0.192
145 H ILE 17 H ILE 17 5.228 -1.854 -3.320
146 HA ILE 17 HA ILE 17 7.440 -3.200 -2.084
147 HB ILE 17 HB ILE 17 4.912 -4.383 -3.257
148 1HG1 ILE 17 2HG1 ILE 17 5.483 -3.515 -0.412
149 2HG1 ILE 17 1HG1 ILE 17 4.455 -2.647 -1.547
150 1HG2 ILE 17 1HG2 ILE 17 6.829 -5.478 -1.200
151 2HG2 ILE 17 2HG2 ILE 17 6.678 -6.028 -2.869
152 3HG2 ILE 17 3HG2 ILE 17 5.340 -6.253 -1.743
153 1HD1 ILE 17 1HD1 ILE 17 3.958 -5.433 -0.526
154 2HD1 ILE 17 2HD1 ILE 17 2.911 -4.518 -1.609
155 3HD1 ILE 17 3HD1 ILE 17 3.163 -3.967 0.048
156 H GLU 18 H GLU 18 6.295 -2.661 -5.262
157 HA GLU 18 HA GLU 18 6.881 -3.292 -7.339
158 1HB GLU 18 2HB GLU 18 9.160 -2.621 -6.573
159 2HB GLU 18 1HB GLU 18 9.458 -4.290 -6.106
160 1HG GLU 18 2HG GLU 18 9.007 -4.930 -8.489
161 2HG GLU 18 1HG GLU 18 8.995 -3.210 -8.874
162 H THR 19 H THR 19 8.761 -5.906 -5.937
163 HA THR 19 HA THR 19 6.556 -7.777 -6.105
164 HB THR 19 HB THR 19 9.052 -8.516 -7.625
165 HG1 THR 19 1HG THR 19 6.995 -6.804 -8.415
166 1HG2 THR 19 1HG2 THR 19 6.172 -9.414 -7.826
167 2HG2 THR 19 2HG2 THR 19 7.468 -10.286 -7.006
168 3HG2 THR 19 3HG2 THR 19 7.526 -10.060 -8.753
169 H HIS 20 H HIS 20 8.734 -6.529 -4.287
170 HA HIS 20 HA HIS 20 9.624 -8.997 -3.026
171 1HB HIS 20 2HB HIS 20 11.426 -8.531 -4.571
172 2HB HIS 20 1HB HIS 20 11.489 -6.850 -4.059
173 HD1 HIS 20 1HD HIS 20 13.479 -6.435 -2.696
174 HD2 HIS 20 2HD HIS 20 11.946 -10.249 -2.050
175 HE1 HIS 20 1HE HIS 20 14.990 -7.495 -0.979
176 HE2 HIS 20 2HE HIS 20 14.181 -9.878 -0.793
177 HA PRO 21 HA PRO 21 8.501 -6.017 0.184
178 1HB PRO 21 2HB PRO 21 7.409 -7.777 1.870
179 2HB PRO 21 1HB PRO 21 6.569 -7.285 0.393
180 1HG PRO 21 2HG PRO 21 8.098 -9.789 0.960
181 2HG PRO 21 1HG PRO 21 6.589 -9.579 0.059
182 1HD PRO 21 2HD PRO 21 9.110 -9.832 -1.076
183 2HD PRO 21 1HD PRO 21 7.687 -9.142 -1.882
184 H GLY 22 H GLY 22 9.109 -5.813 2.473
185 1HA GLY 22 2HA GLY 22 11.764 -6.898 2.945
186 2HA GLY 22 1HA GLY 22 10.961 -5.654 3.891
187 H LYS 23 H LYS 23 8.535 -7.391 4.087
188 HA LYS 23 HA LYS 23 9.535 -9.422 5.969
189 1HB LYS 23 2HB LYS 23 7.185 -7.568 6.410
190 2HB LYS 23 1HB LYS 23 7.613 -8.911 7.455
191 1HG LYS 23 2HG LYS 23 9.753 -7.800 7.962
192 2HG LYS 23 1HG LYS 23 9.252 -6.432 6.964
193 1HD LYS 23 2HD LYS 23 8.808 -5.948 9.299
194 2HD LYS 23 1HD LYS 23 7.285 -6.122 8.427
195 1HE LYS 23 2HE LYS 23 7.176 -8.480 9.235
196 2HE LYS 23 1HE LYS 23 8.602 -8.162 10.220
197 1HZ LYS 23 1HZ LYS 23 7.257 -6.297 11.238
198 2HZ LYS 23 2HZ LYS 23 6.776 -7.877 11.630
199 3HZ LYS 23 3HZ LYS 23 5.895 -6.987 10.492
200 H PHE 24 H PHE 24 6.703 -8.248 4.214
201 HA PHE 24 HA PHE 24 4.944 -9.234 3.210
202 1HB PHE 24 2HB PHE 24 6.759 -10.526 2.005
203 2HB PHE 24 1HB PHE 24 6.519 -11.813 3.182
204 HD1 PHE 24 1HD PHE 24 4.734 -13.341 2.967
205 HD2 PHE 24 2HD PHE 24 4.867 -9.871 0.512
206 HE1 PHE 24 1HE PHE 24 2.893 -14.239 1.603
207 HE2 PHE 24 2HE PHE 24 3.028 -10.761 -0.855
208 HZ PHE 24 HZ PHE 24 2.035 -12.945 -0.310
209 H THR 25 H THR 25 3.827 -8.918 5.165
210 HA THR 25 HA THR 25 2.687 -11.372 6.152
211 HB THR 25 HB THR 25 3.787 -9.398 8.172
212 HG1 THR 25 1HG THR 25 5.043 -11.454 6.848
213 1HG2 THR 25 1HG2 THR 25 3.300 -11.181 9.781
214 2HG2 THR 25 2HG2 THR 25 2.685 -12.196 8.476
215 3HG2 THR 25 3HG2 THR 25 1.846 -10.705 8.904
216 H ASP 26 H ASP 26 0.557 -11.052 6.789
217 HA ASP 26 HA ASP 26 -0.636 -8.500 6.256
218 1HB ASP 26 2HB ASP 26 -2.739 -9.614 7.090
219 2HB ASP 26 1HB ASP 26 -1.960 -10.427 5.739
220 H ASP 27 H ASP 27 0.985 -7.587 7.799
221 HA ASP 27 HA ASP 27 -0.194 -7.293 10.460
222 1HB ASP 27 2HB ASP 27 1.459 -8.544 11.341
223 2HB ASP 27 1HB ASP 27 2.334 -8.588 9.817
224 H PHE 28 H PHE 28 0.306 -5.296 11.464
225 HA PHE 28 HA PHE 28 0.368 -3.177 9.561
226 1HB PHE 28 2HB PHE 28 0.307 -3.135 12.582
227 2HB PHE 28 1HB PHE 28 0.131 -1.710 11.565
228 HD1 PHE 28 1HD PHE 28 -1.853 -1.486 10.096
229 HD2 PHE 28 2HD PHE 28 -1.495 -4.626 12.950
230 HE1 PHE 28 1HE PHE 28 -4.274 -1.897 9.944
231 HE2 PHE 28 2HE PHE 28 -3.914 -5.045 12.796
232 HZ PHE 28 HZ PHE 28 -5.308 -3.680 11.293
233 H ASP 29 H ASP 29 2.739 -4.581 11.720
234 HA ASP 29 HA ASP 29 4.607 -2.436 11.642
235 1HB ASP 29 2HB ASP 29 4.762 -4.215 13.326
236 2HB ASP 29 1HB ASP 29 5.077 -5.397 12.059
237 H THR 30 H THR 30 4.041 -5.273 9.637
238 HA THR 30 HA THR 30 6.150 -4.992 7.826
239 HB THR 30 HB THR 30 3.338 -5.969 7.274
240 HG1 THR 30 1HG THR 30 4.373 -7.159 8.929
241 1HG2 THR 30 1HG2 THR 30 4.358 -7.212 5.420
242 2HG2 THR 30 2HG2 THR 30 5.910 -6.452 5.767
243 3HG2 THR 30 3HG2 THR 30 4.553 -5.473 5.210
244 H ASN 31 H ASN 31 2.843 -3.665 7.670
245 HA ASN 31 HA ASN 31 3.067 -2.103 5.391
246 1HB ASN 31 2HB ASN 31 1.614 -1.430 7.959
247 2HB ASN 31 1HB ASN 31 1.338 -0.655 6.406
248 1HD2 ASN 31 1HD2 ASN 31 -0.440 -2.160 8.163
249 2HD2 ASN 31 2HD2 ASN 31 -1.108 -3.417 7.178
250 H LYS 32 H LYS 32 3.684 -1.164 8.750
251 HA LYS 32 HA LYS 32 4.509 1.435 8.423
252 1HB LYS 32 2HB LYS 32 4.214 0.519 10.617
253 2HB LYS 32 1HB LYS 32 5.480 -0.672 10.355
254 1HG LYS 32 2HG LYS 32 7.051 1.337 10.096
255 2HG LYS 32 1HG LYS 32 5.744 2.275 10.825
256 1HD LYS 32 2HD LYS 32 5.797 0.928 12.807
257 2HD LYS 32 1HD LYS 32 6.926 -0.206 12.064
258 1HE LYS 32 2HE LYS 32 8.574 1.662 11.887
259 2HE LYS 32 1HE LYS 32 7.457 2.667 12.811
260 1HZ LYS 32 1HZ LYS 32 8.647 0.112 13.759
261 2HZ LYS 32 2HZ LYS 32 7.629 1.137 14.657
262 3HZ LYS 32 3HZ LYS 32 9.175 1.662 14.204
263 H LYS 33 H LYS 33 6.610 -1.443 8.421
264 HA LYS 33 HA LYS 33 8.985 0.020 8.014
265 1HB LYS 33 2HB LYS 33 8.838 -2.296 8.961
266 2HB LYS 33 1HB LYS 33 8.517 -2.885 7.334
267 1HG LYS 33 2HG LYS 33 10.681 -1.987 6.602
268 2HG LYS 33 1HG LYS 33 11.006 -1.460 8.253
269 1HD LYS 33 2HD LYS 33 10.789 -3.834 8.982
270 2HD LYS 33 1HD LYS 33 10.643 -4.295 7.285
271 1HE LYS 33 2HE LYS 33 12.995 -2.919 8.579
272 2HE LYS 33 1HE LYS 33 12.928 -4.598 8.047
273 1HZ LYS 33 1HZ LYS 33 12.649 -3.818 5.765
274 2HZ LYS 33 2HZ LYS 33 14.082 -3.216 6.441
275 3HZ LYS 33 3HZ LYS 33 12.734 -2.208 6.287
276 H LEU 34 H LEU 34 6.755 -1.554 5.758
277 HA LEU 34 HA LEU 34 8.488 -1.255 3.512
278 1HB LEU 34 2HB LEU 34 5.692 -2.135 3.943
279 2HB LEU 34 1HB LEU 34 6.100 -1.566 2.336
280 HG LEU 34 HG LEU 34 7.848 -3.263 2.148
281 1HD1 LEU 34 1HD1 LEU 34 8.517 -3.411 4.482
282 2HD1 LEU 34 2HD1 LEU 34 8.099 -5.004 3.848
283 3HD1 LEU 34 3HD1 LEU 34 6.967 -4.145 4.894
284 1HD2 LEU 34 1HD2 LEU 34 5.606 -3.831 1.418
285 2HD2 LEU 34 2HD2 LEU 34 5.196 -4.379 3.043
286 3HD2 LEU 34 3HD2 LEU 34 6.410 -5.245 2.103
287 H VAL 35 H VAL 35 5.677 0.573 4.688
288 HA VAL 35 HA VAL 35 5.585 2.432 2.581
289 HB VAL 35 HB VAL 35 4.783 2.792 5.476
290 1HG1 VAL 35 1HG1 VAL 35 5.148 4.964 4.427
291 2HG1 VAL 35 2HG1 VAL 35 3.428 4.682 4.691
292 3HG1 VAL 35 3HG1 VAL 35 4.114 4.498 3.077
293 1HG2 VAL 35 1HG2 VAL 35 2.510 2.415 4.634
294 2HG2 VAL 35 2HG2 VAL 35 3.557 1.024 4.345
295 3HG2 VAL 35 3HG2 VAL 35 3.163 2.122 3.023
296 H GLU 36 H GLU 36 7.226 2.597 5.736
297 HA GLU 36 HA GLU 36 8.357 5.167 5.195
298 1HB GLU 36 2HB GLU 36 8.908 3.117 7.338
299 2HB GLU 36 1HB GLU 36 9.675 4.699 7.285
300 1HG GLU 36 2HG GLU 36 6.697 4.286 7.382
301 2HG GLU 36 1HG GLU 36 7.704 4.521 8.808
302 H GLU 37 H GLU 37 9.143 2.115 4.092
303 HA GLU 37 HA GLU 37 12.003 2.459 3.989
304 1HB GLU 37 2HB GLU 37 10.602 0.242 3.975
305 2HB GLU 37 1HB GLU 37 10.495 0.541 2.246
306 1HG GLU 37 2HG GLU 37 12.312 -0.925 2.584
307 2HG GLU 37 1HG GLU 37 12.993 0.653 2.199
308 H PHE 38 H PHE 38 9.290 2.623 1.698
309 HA PHE 38 HA PHE 38 11.098 3.906 -0.241
310 1HB PHE 38 2HB PHE 38 8.495 2.464 -0.778
311 2HB PHE 38 1HB PHE 38 9.539 3.187 -1.997
312 HD1 PHE 38 1HD PHE 38 8.999 0.354 0.209
313 HD2 PHE 38 2HD PHE 38 11.696 2.168 -2.534
314 HE1 PHE 38 1HE PHE 38 10.224 -1.769 0.022
315 HE2 PHE 38 2HE PHE 38 12.931 0.046 -2.727
316 HZ PHE 38 HZ PHE 38 12.191 -1.927 -1.448
317 H SER 39 H SER 39 7.599 3.956 -0.421
318 HA SER 39 HA SER 39 6.068 5.625 -0.439
319 1HB SER 39 2HB SER 39 6.706 5.634 1.974
320 2HB SER 39 1HB SER 39 7.879 6.900 1.624
321 HG SER 39 HG SER 39 6.179 8.058 2.187
322 H THR 40 H THR 40 6.089 8.274 -0.226
323 HA THR 40 HA THR 40 8.188 9.435 -1.885
324 HB THR 40 HB THR 40 5.250 9.836 -2.522
325 HG1 THR 40 1HG THR 40 7.237 8.280 -3.874
326 1HG2 THR 40 1HG2 THR 40 6.659 11.760 -3.047
327 2HG2 THR 40 2HG2 THR 40 6.106 10.975 -4.526
328 3HG2 THR 40 3HG2 THR 40 7.756 10.724 -3.960
329 H VAL 41 H VAL 41 4.989 10.248 -0.583
330 HA VAL 41 HA VAL 41 6.223 12.085 1.341
331 HB VAL 41 HB VAL 41 3.751 12.756 -0.283
332 1HG1 VAL 41 1HG1 VAL 41 5.237 14.376 1.778
333 2HG1 VAL 41 2HG1 VAL 41 3.659 13.621 1.991
334 3HG1 VAL 41 3HG1 VAL 41 3.861 14.929 0.825
335 1HG2 VAL 41 1HG2 VAL 41 6.498 13.990 -0.409
336 2HG2 VAL 41 2HG2 VAL 41 5.070 14.550 -1.283
337 3HG2 VAL 41 3HG2 VAL 41 5.761 12.968 -1.644
338 H SER 42 H SER 42 5.823 10.709 3.068
339 HA SER 42 HA SER 42 3.144 9.548 3.239
340 1HB SER 42 2HB SER 42 4.215 8.130 5.077
341 2HB SER 42 1HB SER 42 4.748 7.844 3.422
342 HG SER 42 HG SER 42 6.353 8.154 5.285
343 H THR 43 H THR 43 1.966 11.270 4.005
344 HA THR 43 HA THR 43 2.535 12.285 6.662
345 HB THR 43 HB THR 43 0.235 13.333 6.410
346 HG1 THR 43 1HG THR 43 -0.085 13.289 3.841
347 1HG2 THR 43 1HG2 THR 43 0.986 15.041 4.818
348 2HG2 THR 43 2HG2 THR 43 2.270 13.966 4.267
349 3HG2 THR 43 3HG2 THR 43 2.284 14.581 5.919
350 H LYS 44 H LYS 44 0.532 12.094 8.251
351 HA LYS 44 HA LYS 44 0.376 9.372 8.923
352 1HB LYS 44 2HB LYS 44 -1.260 11.720 9.876
353 2HB LYS 44 1HB LYS 44 -1.392 10.107 10.560
354 1HG LYS 44 2HG LYS 44 1.103 10.262 11.019
355 2HG LYS 44 1HG LYS 44 0.949 11.982 10.649
356 1HD LYS 44 2HD LYS 44 -0.736 12.215 12.399
357 2HD LYS 44 1HD LYS 44 -0.604 10.493 12.762
358 1HE LYS 44 2HE LYS 44 1.805 10.865 13.283
359 2HE LYS 44 1HE LYS 44 1.529 12.595 13.085
360 1HZ LYS 44 1HZ LYS 44 1.383 12.095 15.383
361 2HZ LYS 44 2HZ LYS 44 0.324 10.798 15.113
362 3HZ LYS 44 3HZ LYS 44 -0.202 12.389 14.848
363 H HIS 45 H HIS 45 -2.157 11.530 7.632
364 HA HIS 45 HA HIS 45 -4.110 9.474 7.537
365 1HB HIS 45 2HB HIS 45 -4.544 11.972 7.609
366 2HB HIS 45 1HB HIS 45 -4.136 12.010 5.896
367 HD1 HIS 45 1HD HIS 45 -6.591 12.831 5.434
368 HD2 HIS 45 2HD HIS 45 -6.294 9.007 7.051
369 HE1 HIS 45 1HE HIS 45 -8.853 11.774 5.111
370 HE2 HIS 45 2HE HIS 45 -8.704 9.551 6.290
371 H LEU 46 H LEU 46 -1.612 10.472 5.336
372 HA LEU 46 HA LEU 46 -2.725 9.102 3.066
373 1HB LEU 46 2HB LEU 46 -1.161 11.047 2.896
374 2HB LEU 46 1HB LEU 46 0.118 10.024 3.513
375 HG LEU 46 HG LEU 46 -1.322 9.136 1.053
376 1HD1 LEU 46 1HD1 LEU 46 0.190 10.467 -0.336
377 2HD1 LEU 46 2HD1 LEU 46 0.794 11.283 1.107
378 3HD1 LEU 46 3HD1 LEU 46 -0.888 11.486 0.617
379 1HD2 LEU 46 1HD2 LEU 46 0.901 8.284 0.489
380 2HD2 LEU 46 2HD2 LEU 46 0.369 7.699 2.065
381 3HD2 LEU 46 3HD2 LEU 46 1.553 9.002 1.962
382 H ARG 47 H ARG 47 -0.253 8.430 5.508
383 HA ARG 47 HA ARG 47 0.607 5.937 4.563
384 1HB ARG 47 2HB ARG 47 1.788 7.095 6.344
385 2HB ARG 47 1HB ARG 47 0.394 6.951 7.406
386 1HG ARG 47 2HG ARG 47 0.654 4.470 7.279
387 2HG ARG 47 1HG ARG 47 2.161 4.733 6.399
388 1HD ARG 47 2HD ARG 47 1.559 5.808 9.152
389 2HD ARG 47 1HD ARG 47 2.483 4.342 8.829
390 HE ARG 47 HE ARG 47 3.891 6.100 7.441
391 1HH1 ARG 47 1HH1 ARG 47 2.492 6.410 10.636
392 2HH1 ARG 47 2HH1 ARG 47 3.760 7.445 11.232
393 1HH2 ARG 47 1HH2 ARG 47 5.577 7.461 8.224
394 2HH2 ARG 47 2HH2 ARG 47 5.499 8.041 9.861
395 H ASN 48 H ASN 48 -2.104 6.829 6.622
396 HA ASN 48 HA ASN 48 -3.003 4.293 7.348
397 1HB ASN 48 2HB ASN 48 -4.453 6.900 6.924
398 2HB ASN 48 1HB ASN 48 -5.295 5.448 7.457
399 1HD2 ASN 48 1HD2 ASN 48 -5.828 6.549 9.385
400 2HD2 ASN 48 2HD2 ASN 48 -4.666 6.739 10.653
401 H LYS 49 H LYS 49 -3.553 6.138 4.398
402 HA LYS 49 HA LYS 49 -5.529 4.388 3.319
403 1HB LYS 49 2HB LYS 49 -3.668 6.211 1.776
404 2HB LYS 49 1HB LYS 49 -5.224 5.591 1.246
405 1HG LYS 49 2HG LYS 49 -4.870 7.440 3.588
406 2HG LYS 49 1HG LYS 49 -5.215 7.987 1.950
407 1HD LYS 49 2HD LYS 49 -6.968 6.034 3.430
408 2HD LYS 49 1HD LYS 49 -7.205 7.781 3.508
409 1HE LYS 49 2HE LYS 49 -7.346 7.764 0.995
410 2HE LYS 49 1HE LYS 49 -7.371 6.004 1.080
411 1HZ LYS 49 1HZ LYS 49 -9.395 6.106 2.367
412 2HZ LYS 49 2HZ LYS 49 -9.601 6.980 0.930
413 3HZ LYS 49 3HZ LYS 49 -9.347 7.800 2.392
414 H ILE 50 H ILE 50 -2.049 4.808 2.781
415 HA ILE 50 HA ILE 50 -1.732 2.783 0.861
416 HB ILE 50 HB ILE 50 0.334 3.764 2.840
417 1HG1 ILE 50 2HG1 ILE 50 -0.678 5.607 1.545
418 2HG1 ILE 50 1HG1 ILE 50 1.008 5.354 1.116
419 1HG2 ILE 50 1HG2 ILE 50 1.972 3.048 1.166
420 2HG2 ILE 50 2HG2 ILE 50 0.669 2.406 0.166
421 3HG2 ILE 50 3HG2 ILE 50 1.000 1.696 1.747
422 1HD1 ILE 50 1HD1 ILE 50 0.307 4.160 -0.902
423 2HD1 ILE 50 2HD1 ILE 50 -0.337 5.800 -0.845
424 3HD1 ILE 50 3HD1 ILE 50 -1.381 4.431 -0.467
425 H ALA 51 H ALA 51 -1.102 2.715 4.364
426 HA ALA 51 HA ALA 51 -0.226 0.059 4.509
427 1HB ALA 51 1HB ALA 51 0.115 1.695 6.291
428 2HB ALA 51 2HB ALA 51 -0.652 0.229 6.902
429 3HB ALA 51 3HB ALA 51 -1.614 1.682 6.634
430 H GLY 52 H GLY 52 -3.463 1.445 4.708
431 1HA GLY 52 2HA GLY 52 -4.865 -0.844 5.489
432 2HA GLY 52 1HA GLY 52 -5.530 0.470 4.530
433 H TYR 53 H TYR 53 -3.987 0.288 2.246
434 HA TYR 53 HA TYR 53 -5.318 -1.860 0.932
435 1HB TYR 53 2HB TYR 53 -3.457 0.305 0.055
436 2HB TYR 53 1HB TYR 53 -3.776 -1.049 -1.027
437 HD1 TYR 53 1HD TYR 53 -5.469 1.613 0.941
438 HD2 TYR 53 2HD TYR 53 -5.716 -1.091 -2.332
439 HE1 TYR 53 1HE TYR 53 -7.567 2.674 0.230
440 HE2 TYR 53 2HE TYR 53 -7.814 -0.036 -3.056
441 HH TYR 53 HH TYR 53 -8.870 2.916 -1.933
442 H ILE 54 H ILE 54 -1.970 -1.323 1.968
443 HA ILE 54 HA ILE 54 -0.790 -3.487 0.649
444 HB ILE 54 HB ILE 54 -0.076 -2.471 3.407
445 1HG1 ILE 54 2HG1 ILE 54 1.029 -1.684 0.700
446 2HG1 ILE 54 1HG1 ILE 54 -0.035 -0.694 1.698
447 1HG2 ILE 54 1HG2 ILE 54 0.896 -4.660 2.939
448 2HG2 ILE 54 2HG2 ILE 54 2.143 -3.415 2.942
449 3HG2 ILE 54 3HG2 ILE 54 1.546 -4.058 1.413
450 1HD1 ILE 54 1HD1 ILE 54 2.238 0.048 1.940
451 2HD1 ILE 54 2HD1 ILE 54 2.757 -1.579 2.380
452 3HD1 ILE 54 3HD1 ILE 54 1.688 -0.674 3.453
453 H THR 55 H THR 55 -1.993 -3.386 4.010
454 HA THR 55 HA THR 55 -1.839 -6.047 4.647
455 HB THR 55 HB THR 55 -4.306 -4.530 5.434
456 HG1 THR 55 1HG THR 55 -2.656 -2.981 5.607
457 1HG2 THR 55 1HG2 THR 55 -3.940 -6.775 6.334
458 2HG2 THR 55 2HG2 THR 55 -3.821 -5.560 7.607
459 3HG2 THR 55 3HG2 THR 55 -2.359 -6.279 6.935
460 H ARG 56 H ARG 56 -4.490 -4.409 2.916
461 HA ARG 56 HA ARG 56 -6.190 -6.612 2.629
462 1HB ARG 56 2HB ARG 56 -5.783 -4.224 0.830
463 2HB ARG 56 1HB ARG 56 -7.059 -5.408 0.596
464 1HG ARG 56 2HG ARG 56 -7.971 -4.855 2.792
465 2HG ARG 56 1HG ARG 56 -6.695 -3.657 3.015
466 1HD ARG 56 2HD ARG 56 -7.491 -2.391 1.122
467 2HD ARG 56 1HD ARG 56 -8.694 -3.626 0.758
468 HE ARG 56 HE ARG 56 -9.025 -2.644 3.404
469 1HH1 ARG 56 1HH1 ARG 56 -9.581 -1.768 0.043
470 2HH1 ARG 56 2HH1 ARG 56 -10.927 -0.730 0.414
471 1HH2 ARG 56 1HH2 ARG 56 -10.793 -1.295 3.873
472 2HH2 ARG 56 2HH2 ARG 56 -11.626 -0.466 2.588
473 H ILE 57 H ILE 57 -3.704 -5.385 0.395
474 HA ILE 57 HA ILE 57 -4.038 -7.295 -1.610
475 HB ILE 57 HB ILE 57 -1.508 -5.854 -0.792
476 1HG1 ILE 57 2HG1 ILE 57 -3.534 -5.230 -2.956
477 2HG1 ILE 57 1HG1 ILE 57 -3.390 -4.377 -1.423
478 1HG2 ILE 57 1HG2 ILE 57 -0.708 -6.345 -3.064
479 2HG2 ILE 57 2HG2 ILE 57 -2.145 -7.324 -3.350
480 3HG2 ILE 57 3HG2 ILE 57 -0.973 -7.815 -2.127
481 1HD1 ILE 57 1HD1 ILE 57 -1.216 -4.506 -3.495
482 2HD1 ILE 57 2HD1 ILE 57 -1.232 -3.533 -2.025
483 3HD1 ILE 57 3HD1 ILE 57 -2.370 -3.184 -3.328
484 H ILE 58 H ILE 58 -1.872 -7.326 1.211
485 HA ILE 58 HA ILE 58 -0.656 -9.801 0.634
486 HB ILE 58 HB ILE 58 -1.041 -8.488 3.332
487 1HG1 ILE 58 2HG1 ILE 58 1.289 -8.409 1.398
488 2HG1 ILE 58 1HG1 ILE 58 0.152 -7.093 1.673
489 1HG2 ILE 58 1HG2 ILE 58 0.897 -10.639 2.474
490 2HG2 ILE 58 2HG2 ILE 58 -0.494 -10.867 3.534
491 3HG2 ILE 58 3HG2 ILE 58 0.856 -9.856 4.053
492 1HD1 ILE 58 1HD1 ILE 58 2.250 -6.731 2.841
493 2HD1 ILE 58 2HD1 ILE 58 2.034 -8.248 3.716
494 3HD1 ILE 58 3HD1 ILE 58 0.914 -6.911 3.976
495 H SER 59 H SER 59 -3.624 -8.981 2.342
496 HA SER 59 HA SER 59 -4.137 -11.537 3.421
497 1HB SER 59 2HB SER 59 -6.136 -9.424 2.574
498 2HB SER 59 1HB SER 59 -6.459 -10.781 3.651
499 HG SER 59 HG SER 59 -4.512 -8.771 4.152
500 H GLN 60 H GLN 60 -4.961 -10.066 0.298
501 HA GLN 60 HA GLN 60 -6.418 -12.377 -0.590
502 1HB GLN 60 2HB GLN 60 -5.551 -9.821 -1.875
503 2HB GLN 60 1HB GLN 60 -6.068 -11.158 -2.889
504 1HG GLN 60 2HG GLN 60 -7.974 -9.850 -2.600
505 2HG GLN 60 1HG GLN 60 -8.185 -11.206 -1.498
506 1HE2 GLN 60 1HE2 GLN 60 -7.672 -7.813 -1.803
507 2HE2 GLN 60 2HE2 GLN 60 -7.939 -7.408 -0.146
508 H GLN 61 H GLN 61 -3.113 -11.293 -0.743
509 HA GLN 61 HA GLN 61 -2.359 -13.271 -2.726
510 1HB GLN 61 2HB GLN 61 -0.713 -11.357 -1.071
511 2HB GLN 61 1HB GLN 61 -0.044 -12.440 -2.282
512 1HG GLN 61 2HG GLN 61 -2.090 -10.306 -2.842
513 2HG GLN 61 1HG GLN 61 -0.354 -10.120 -3.073
514 1HE2 GLN 61 1HE2 GLN 61 -3.256 -11.642 -4.235
515 2HE2 GLN 61 2HE2 GLN 61 -2.613 -12.153 -5.755
516 H LYS 62 H LYS 62 -3.162 -13.496 0.411
517 HA LYS 62 HA LYS 62 -1.169 -15.288 1.395
518 1HB LYS 62 2HB LYS 62 -2.691 -14.039 2.889
519 2HB LYS 62 1HB LYS 62 -4.059 -14.921 2.227
520 1HG LYS 62 2HG LYS 62 -3.654 -16.026 4.211
521 2HG LYS 62 1HG LYS 62 -2.795 -17.027 3.039
522 1HD LYS 62 2HD LYS 62 -1.426 -16.686 5.010
523 2HD LYS 62 1HD LYS 62 -0.698 -15.869 3.624
524 1HE LYS 62 2HE LYS 62 -1.632 -13.746 4.374
525 2HE LYS 62 1HE LYS 62 -2.404 -14.555 5.736
526 1HZ LYS 62 1HZ LYS 62 -0.382 -13.479 6.428
527 2HZ LYS 62 2HZ LYS 62 0.517 -14.327 5.265
528 3HZ LYS 62 3HZ LYS 62 -0.201 -15.161 6.556
Start of MODEL 9
1 1H MET 1 1HT MET 1 -16.416 4.559 -16.107
2 2H MET 1 2HT MET 1 -16.662 3.099 -15.280
3 3H MET 1 3HT MET 1 -15.692 4.307 -14.597
4 HA MET 1 HA MET 1 -17.516 5.747 -14.272
5 1HB MET 1 2HB MET 1 -19.169 3.608 -15.633
6 2HB MET 1 1HB MET 1 -19.810 5.057 -14.873
7 1HG MET 1 2HG MET 1 -18.663 6.444 -16.490
8 2HG MET 1 1HG MET 1 -17.938 5.016 -17.227
9 1HE MET 1 1HE MET 1 -21.623 5.520 -15.873
10 2HE MET 1 2HE MET 1 -22.434 6.041 -17.350
11 3HE MET 1 3HE MET 1 -21.199 7.064 -16.614
12 H GLY 2 H GLY 2 -18.828 2.441 -14.170
13 1HA GLY 2 2HA GLY 2 -18.709 2.602 -11.221
14 2HA GLY 2 1HA GLY 2 -19.918 1.699 -12.123
15 H ASN 3 H ASN 3 -17.291 1.186 -13.838
16 HA ASN 3 HA ASN 3 -16.706 -1.394 -12.727
17 1HB ASN 3 2HB ASN 3 -15.123 -1.575 -14.624
18 2HB ASN 3 1HB ASN 3 -16.725 -1.079 -15.154
19 1HD2 ASN 3 1HD2 ASN 3 -14.191 -0.742 -16.506
20 2HD2 ASN 3 2HD2 ASN 3 -13.971 0.960 -16.733
21 H ILE 4 H ILE 4 -13.883 -1.473 -13.290
22 HA ILE 4 HA ILE 4 -12.789 -0.810 -10.836
23 HB ILE 4 HB ILE 4 -10.550 -0.966 -11.943
24 1HG1 ILE 4 2HG1 ILE 4 -12.185 -1.496 -14.436
25 2HG1 ILE 4 1HG1 ILE 4 -11.252 -0.033 -14.141
26 1HG2 ILE 4 1HG2 ILE 4 -10.775 -3.343 -12.530
27 2HG2 ILE 4 2HG2 ILE 4 -12.528 -3.158 -12.562
28 3HG2 ILE 4 3HG2 ILE 4 -11.646 -2.938 -11.051
29 1HD1 ILE 4 1HD1 ILE 4 -10.139 -2.817 -14.388
30 2HD1 ILE 4 2HD1 ILE 4 -9.201 -1.353 -14.091
31 3HD1 ILE 4 3HD1 ILE 4 -10.071 -1.550 -15.612
32 H ARG 5 H ARG 5 -12.132 1.003 -9.910
33 HA ARG 5 HA ARG 5 -11.441 3.337 -11.507
34 1HB ARG 5 2HB ARG 5 -13.979 3.248 -11.022
35 2HB ARG 5 1HB ARG 5 -13.541 3.584 -9.354
36 1HG ARG 5 2HG ARG 5 -12.528 5.681 -10.006
37 2HG ARG 5 1HG ARG 5 -12.845 5.331 -11.706
38 1HD ARG 5 2HD ARG 5 -14.557 6.809 -11.009
39 2HD ARG 5 1HD ARG 5 -15.293 5.211 -11.106
40 HE ARG 5 HE ARG 5 -14.391 6.386 -8.548
41 1HH1 ARG 5 1HH1 ARG 5 -16.819 4.735 -10.479
42 2HH1 ARG 5 2HH1 ARG 5 -17.943 4.589 -9.160
43 1HH2 ARG 5 1HH2 ARG 5 -15.881 6.196 -6.830
44 2HH2 ARG 5 2HH2 ARG 5 -17.415 5.430 -7.104
45 H THR 6 H THR 6 -10.323 4.946 -10.284
46 HA THR 6 HA THR 6 -8.860 5.713 -8.721
47 HB THR 6 HB THR 6 -10.115 3.840 -6.706
48 HG1 THR 6 1HG THR 6 -11.497 5.751 -6.295
49 1HG2 THR 6 1HG2 THR 6 -9.531 5.598 -5.116
50 2HG2 THR 6 2HG2 THR 6 -8.887 6.587 -6.426
51 3HG2 THR 6 3HG2 THR 6 -8.095 5.070 -5.996
52 H SER 7 H SER 7 -8.340 3.318 -10.360
53 HA SER 7 HA SER 7 -6.819 1.407 -8.970
54 1HB SER 7 2HB SER 7 -6.444 2.324 -11.827
55 2HB SER 7 1HB SER 7 -6.004 0.754 -11.151
56 HG SER 7 HG SER 7 -8.054 0.142 -11.147
57 H PHE 8 H PHE 8 -6.214 4.649 -9.447
58 HA PHE 8 HA PHE 8 -3.464 4.828 -9.848
59 1HB PHE 8 2HB PHE 8 -5.103 6.631 -8.056
60 2HB PHE 8 1HB PHE 8 -3.626 7.045 -8.920
61 HD1 PHE 8 1HD PHE 8 -7.169 7.056 -9.004
62 HD2 PHE 8 2HD PHE 8 -3.720 6.949 -11.489
63 HE1 PHE 8 1HE PHE 8 -8.520 7.842 -10.905
64 HE2 PHE 8 2HE PHE 8 -5.061 7.739 -13.391
65 HZ PHE 8 HZ PHE 8 -7.465 8.186 -13.103
66 H VAL 9 H VAL 9 -5.343 4.200 -6.945
67 HA VAL 9 HA VAL 9 -3.262 4.490 -5.057
68 HB VAL 9 HB VAL 9 -5.750 2.778 -4.877
69 1HG1 VAL 9 1HG1 VAL 9 -5.449 2.941 -2.452
70 2HG1 VAL 9 2HG1 VAL 9 -3.932 3.806 -2.701
71 3HG1 VAL 9 3HG1 VAL 9 -4.084 2.130 -3.223
72 1HG2 VAL 9 1HG2 VAL 9 -5.253 5.607 -3.951
73 2HG2 VAL 9 2HG2 VAL 9 -6.722 4.674 -3.671
74 3HG2 VAL 9 3HG2 VAL 9 -6.263 5.124 -5.312
75 H LYS 10 H LYS 10 -4.398 1.773 -6.981
76 HA LYS 10 HA LYS 10 -2.927 -0.267 -5.756
77 1HB LYS 10 2HB LYS 10 -4.704 -0.741 -7.349
78 2HB LYS 10 1HB LYS 10 -3.790 0.031 -8.639
79 1HG LYS 10 2HG LYS 10 -2.024 -1.705 -8.333
80 2HG LYS 10 1HG LYS 10 -3.100 -2.518 -7.191
81 1HD LYS 10 2HD LYS 10 -4.768 -2.805 -8.923
82 2HD LYS 10 1HD LYS 10 -3.776 -1.901 -10.067
83 1HE LYS 10 2HE LYS 10 -3.562 -4.286 -10.462
84 2HE LYS 10 1HE LYS 10 -2.034 -3.614 -9.897
85 1HZ LYS 10 1HZ LYS 10 -2.780 -5.789 -8.881
86 2HZ LYS 10 2HZ LYS 10 -3.949 -4.892 -8.040
87 3HZ LYS 10 3HZ LYS 10 -2.302 -4.572 -7.804
88 H ARG 11 H ARG 11 -2.108 1.863 -8.490
89 HA ARG 11 HA ARG 11 0.429 0.721 -8.988
90 1HB ARG 11 2HB ARG 11 -0.880 2.272 -10.529
91 2HB ARG 11 1HB ARG 11 -0.302 3.602 -9.532
92 1HG ARG 11 2HG ARG 11 2.031 2.844 -10.015
93 2HG ARG 11 1HG ARG 11 1.354 1.695 -11.167
94 1HD ARG 11 2HD ARG 11 1.164 4.699 -11.254
95 2HD ARG 11 1HD ARG 11 2.079 3.660 -12.344
96 HE ARG 11 HE ARG 11 -0.835 3.999 -12.285
97 1HH1 ARG 11 1HH1 ARG 11 2.013 2.624 -13.801
98 2HH1 ARG 11 2HH1 ARG 11 1.195 2.271 -15.293
99 1HH2 ARG 11 1HH2 ARG 11 -1.901 3.553 -14.258
100 2HH2 ARG 11 2HH2 ARG 11 -1.016 2.810 -15.564
101 H ILE 12 H ILE 12 -0.605 3.435 -6.964
102 HA ILE 12 HA ILE 12 1.962 4.284 -6.178
103 HB ILE 12 HB ILE 12 -0.665 4.536 -4.696
104 1HG1 ILE 12 2HG1 ILE 12 0.834 6.503 -6.443
105 2HG1 ILE 12 1HG1 ILE 12 -0.612 5.619 -6.920
106 1HG2 ILE 12 1HG2 ILE 12 1.954 5.964 -4.234
107 2HG2 ILE 12 2HG2 ILE 12 1.195 4.793 -3.154
108 3HG2 ILE 12 3HG2 ILE 12 0.423 6.351 -3.446
109 1HD1 ILE 12 1HD1 ILE 12 -1.888 6.774 -5.180
110 2HD1 ILE 12 2HD1 ILE 12 -1.138 7.910 -6.300
111 3HD1 ILE 12 3HD1 ILE 12 -0.436 7.653 -4.703
112 H ALA 13 H ALA 13 -0.299 1.979 -4.710
113 HA ALA 13 HA ALA 13 1.259 1.397 -2.429
114 1HB ALA 13 1HB ALA 13 -0.162 -0.579 -2.194
115 2HB ALA 13 2HB ALA 13 -0.769 -0.339 -3.832
116 3HB ALA 13 3HB ALA 13 -1.117 0.852 -2.581
117 H LYS 14 H LYS 14 1.046 -0.144 -5.613
118 HA LYS 14 HA LYS 14 2.739 -2.316 -5.139
119 1HB LYS 14 2HB LYS 14 1.292 -2.024 -7.140
120 2HB LYS 14 1HB LYS 14 2.388 -0.778 -7.721
121 1HG LYS 14 2HG LYS 14 4.186 -2.427 -7.853
122 2HG LYS 14 1HG LYS 14 3.076 -3.673 -7.277
123 1HD LYS 14 2HD LYS 14 1.631 -3.210 -9.247
124 2HD LYS 14 1HD LYS 14 2.873 -2.104 -9.841
125 1HE LYS 14 2HE LYS 14 3.082 -4.293 -10.892
126 2HE LYS 14 1HE LYS 14 4.489 -3.930 -9.893
127 1HZ LYS 14 1HZ LYS 14 3.774 -6.195 -9.545
128 2HZ LYS 14 2HZ LYS 14 2.212 -5.679 -9.133
129 3HZ LYS 14 3HZ LYS 14 3.516 -5.299 -8.128
130 H GLU 15 H GLU 15 3.482 0.892 -6.449
131 HA GLU 15 HA GLU 15 6.267 0.446 -6.710
132 1HB GLU 15 2HB GLU 15 4.982 2.138 -7.977
133 2HB GLU 15 1HB GLU 15 4.744 3.050 -6.496
134 1HG GLU 15 2HG GLU 15 7.001 3.649 -6.372
135 2HG GLU 15 1HG GLU 15 7.479 2.422 -7.545
136 H MET 16 H MET 16 4.235 1.466 -4.095
137 HA MET 16 HA MET 16 6.249 2.535 -2.394
138 1HB MET 16 2HB MET 16 3.781 2.927 -2.163
139 2HB MET 16 1HB MET 16 3.617 1.265 -1.617
140 1HG MET 16 2HG MET 16 3.637 2.505 0.342
141 2HG MET 16 1HG MET 16 5.285 1.896 0.211
142 1HE MET 16 1HE MET 16 3.691 4.806 -1.901
143 2HE MET 16 2HE MET 16 4.067 6.208 -0.901
144 3HE MET 16 3HE MET 16 2.928 4.993 -0.322
145 H ILE 17 H ILE 17 4.883 -0.671 -2.888
146 HA ILE 17 HA ILE 17 6.081 -1.829 -0.565
147 HB ILE 17 HB ILE 17 4.758 -3.081 -2.971
148 1HG1 ILE 17 2HG1 ILE 17 3.797 -2.741 -0.121
149 2HG1 ILE 17 1HG1 ILE 17 3.320 -1.722 -1.473
150 1HG2 ILE 17 1HG2 ILE 17 4.694 -5.173 -1.707
151 2HG2 ILE 17 2HG2 ILE 17 5.654 -4.431 -0.427
152 3HG2 ILE 17 3HG2 ILE 17 6.352 -4.663 -2.029
153 1HD1 ILE 17 1HD1 ILE 17 2.286 -3.638 -2.565
154 2HD1 ILE 17 2HD1 ILE 17 1.616 -3.374 -0.954
155 3HD1 ILE 17 3HD1 ILE 17 2.779 -4.670 -1.222
156 H GLU 18 H GLU 18 6.916 -1.756 -4.002
157 HA GLU 18 HA GLU 18 8.702 -3.937 -3.927
158 1HB GLU 18 2HB GLU 18 9.354 -3.304 -6.146
159 2HB GLU 18 1HB GLU 18 7.618 -3.073 -5.978
160 1HG GLU 18 2HG GLU 18 7.862 -0.720 -5.831
161 2HG GLU 18 1HG GLU 18 9.613 -0.850 -5.676
162 H THR 19 H THR 19 9.146 -0.857 -2.642
163 HA THR 19 HA THR 19 11.942 -0.630 -3.288
164 HB THR 19 HB THR 19 10.527 1.378 -2.949
165 HG1 THR 19 1HG THR 19 12.227 2.457 -2.199
166 1HG2 THR 19 1HG2 THR 19 9.977 2.093 -0.675
167 2HG2 THR 19 2HG2 THR 19 10.583 0.561 -0.043
168 3HG2 THR 19 3HG2 THR 19 9.160 0.587 -1.088
169 H HIS 20 H HIS 20 10.059 -2.039 -0.718
170 HA HIS 20 HA HIS 20 12.571 -2.762 0.627
171 1HB HIS 20 2HB HIS 20 10.192 -1.436 1.800
172 2HB HIS 20 1HB HIS 20 10.910 -2.733 2.746
173 HD1 HIS 20 1HD HIS 20 11.723 -1.103 4.560
174 HD2 HIS 20 2HD HIS 20 13.273 -0.312 0.785
175 HE1 HIS 20 1HE HIS 20 13.572 0.558 4.924
176 HE2 HIS 20 2HE HIS 20 14.287 1.231 2.604
177 HA PRO 21 HA PRO 21 10.352 -6.671 0.075
178 1HB PRO 21 2HB PRO 21 12.417 -8.085 -0.839
179 2HB PRO 21 1HB PRO 21 11.620 -6.890 -1.869
180 1HG PRO 21 2HG PRO 21 14.228 -6.726 -0.439
181 2HG PRO 21 1HG PRO 21 13.755 -6.040 -2.003
182 1HD PRO 21 2HD PRO 21 13.832 -4.696 0.477
183 2HD PRO 21 1HD PRO 21 13.115 -4.098 -1.031
184 H GLY 22 H GLY 22 11.238 -5.709 2.629
185 1HA GLY 22 2HA GLY 22 13.186 -7.505 3.738
186 2HA GLY 22 1HA GLY 22 12.273 -6.287 4.609
187 H LYS 23 H LYS 23 9.710 -7.012 4.396
188 HA LYS 23 HA LYS 23 9.702 -9.672 5.669
189 1HB LYS 23 2HB LYS 23 8.032 -7.255 6.386
190 2HB LYS 23 1HB LYS 23 7.892 -8.841 7.129
191 1HG LYS 23 2HG LYS 23 10.209 -8.620 7.947
192 2HG LYS 23 1HG LYS 23 10.264 -6.993 7.265
193 1HD LYS 23 2HD LYS 23 9.744 -6.781 9.588
194 2HD LYS 23 1HD LYS 23 8.275 -6.425 8.680
195 1HE LYS 23 2HE LYS 23 7.557 -8.784 9.060
196 2HE LYS 23 1HE LYS 23 8.960 -8.994 10.104
197 1HZ LYS 23 1HZ LYS 23 7.320 -8.466 11.598
198 2HZ LYS 23 2HZ LYS 23 6.532 -7.397 10.555
199 3HZ LYS 23 3HZ LYS 23 7.976 -6.925 11.309
200 H PHE 24 H PHE 24 7.736 -10.893 5.511
201 HA PHE 24 HA PHE 24 5.705 -9.954 3.653
202 1HB PHE 24 2HB PHE 24 7.327 -11.129 2.214
203 2HB PHE 24 1HB PHE 24 7.185 -12.562 3.225
204 HD1 PHE 24 1HD PHE 24 5.783 -14.237 2.519
205 HD2 PHE 24 2HD PHE 24 4.995 -10.235 1.291
206 HE1 PHE 24 1HE PHE 24 3.910 -15.032 1.136
207 HE2 PHE 24 2HE PHE 24 3.122 -11.027 -0.094
208 HZ PHE 24 HZ PHE 24 2.578 -13.426 -0.175
209 H THR 25 H THR 25 4.388 -9.898 5.490
210 HA THR 25 HA THR 25 3.093 -12.414 6.093
211 HB THR 25 HB THR 25 4.144 -10.759 8.410
212 HG1 THR 25 1HG THR 25 5.398 -12.697 6.909
213 1HG2 THR 25 1HG2 THR 25 2.927 -13.524 8.288
214 2HG2 THR 25 2HG2 THR 25 2.150 -12.069 8.915
215 3HG2 THR 25 3HG2 THR 25 3.554 -12.744 9.741
216 H ASP 26 H ASP 26 1.019 -11.990 7.318
217 HA ASP 26 HA ASP 26 -0.213 -9.532 6.470
218 1HB ASP 26 2HB ASP 26 -2.226 -10.431 7.656
219 2HB ASP 26 1HB ASP 26 -1.567 -11.523 6.447
220 H ASP 27 H ASP 27 1.984 -9.231 8.259
221 HA ASP 27 HA ASP 27 0.799 -8.388 10.794
222 1HB ASP 27 2HB ASP 27 2.613 -9.569 11.465
223 2HB ASP 27 1HB ASP 27 3.433 -9.378 9.922
224 H PHE 28 H PHE 28 1.071 -6.293 11.592
225 HA PHE 28 HA PHE 28 0.969 -4.307 9.532
226 1HB PHE 28 2HB PHE 28 0.694 -4.167 12.526
227 2HB PHE 28 1HB PHE 28 0.637 -2.733 11.505
228 HD1 PHE 28 1HD PHE 28 -1.213 -2.366 9.974
229 HD2 PHE 28 2HD PHE 28 -1.114 -5.756 12.544
230 HE1 PHE 28 1HE PHE 28 -3.606 -2.746 9.554
231 HE2 PHE 28 2HE PHE 28 -3.507 -6.144 12.128
232 HZ PHE 28 HZ PHE 28 -4.757 -4.639 10.631
233 H ASP 29 H ASP 29 3.419 -5.375 11.763
234 HA ASP 29 HA ASP 29 5.093 -3.086 11.579
235 1HB ASP 29 2HB ASP 29 5.473 -4.769 13.300
236 2HB ASP 29 1HB ASP 29 5.803 -5.988 12.074
237 H THR 30 H THR 30 4.595 -5.910 9.614
238 HA THR 30 HA THR 30 6.719 -5.806 7.850
239 HB THR 30 HB THR 30 3.845 -6.581 7.310
240 HG1 THR 30 1HG THR 30 4.940 -7.786 8.965
241 1HG2 THR 30 1HG2 THR 30 5.035 -6.171 5.208
242 2HG2 THR 30 2HG2 THR 30 4.720 -7.892 5.432
243 3HG2 THR 30 3HG2 THR 30 6.334 -7.244 5.725
244 H ASN 31 H ASN 31 3.487 -4.332 7.317
245 HA ASN 31 HA ASN 31 4.303 -2.996 4.959
246 1HB ASN 31 2HB ASN 31 2.200 -1.723 5.148
247 2HB ASN 31 1HB ASN 31 1.942 -3.450 5.367
248 1HD2 ASN 31 1HD2 ASN 31 1.978 -0.337 6.914
249 2HD2 ASN 31 2HD2 ASN 31 1.164 -0.826 8.356
250 H LYS 32 H LYS 32 4.474 -2.169 8.330
251 HA LYS 32 HA LYS 32 4.896 0.605 8.063
252 1HB LYS 32 2HB LYS 32 4.375 -0.519 10.202
253 2HB LYS 32 1HB LYS 32 5.964 -1.270 10.184
254 1HG LYS 32 2HG LYS 32 6.992 0.966 10.266
255 2HG LYS 32 1HG LYS 32 5.383 1.679 10.366
256 1HD LYS 32 2HD LYS 32 6.352 1.517 12.577
257 2HD LYS 32 1HD LYS 32 4.980 0.415 12.444
258 1HE LYS 32 2HE LYS 32 6.543 -1.434 12.002
259 2HE LYS 32 1HE LYS 32 7.895 -0.321 12.207
260 1HZ LYS 32 1HZ LYS 32 7.112 0.088 14.487
261 2HZ LYS 32 2HZ LYS 32 7.548 -1.527 14.224
262 3HZ LYS 32 3HZ LYS 32 5.910 -1.091 14.275
263 H LYS 33 H LYS 33 7.125 -2.145 8.084
264 HA LYS 33 HA LYS 33 9.512 -0.641 7.907
265 1HB LYS 33 2HB LYS 33 8.913 -3.470 7.018
266 2HB LYS 33 1HB LYS 33 10.525 -2.772 7.099
267 1HG LYS 33 2HG LYS 33 8.652 -3.165 9.426
268 2HG LYS 33 1HG LYS 33 10.056 -4.161 9.038
269 1HD LYS 33 2HD LYS 33 11.524 -2.243 9.357
270 2HD LYS 33 1HD LYS 33 10.129 -1.215 9.699
271 1HE LYS 33 2HE LYS 33 9.604 -2.595 11.653
272 2HE LYS 33 1HE LYS 33 11.003 -3.612 11.308
273 1HZ LYS 33 1HZ LYS 33 11.097 -0.715 11.959
274 2HZ LYS 33 2HZ LYS 33 12.441 -1.704 11.647
275 3HZ LYS 33 3HZ LYS 33 11.489 -1.976 13.023
276 H LEU 34 H LEU 34 7.247 -1.811 5.514
277 HA LEU 34 HA LEU 34 8.859 -1.207 3.243
278 1HB LEU 34 2HB LEU 34 5.974 -1.865 3.682
279 2HB LEU 34 1HB LEU 34 6.477 -1.229 2.130
280 HG LEU 34 HG LEU 34 7.922 -3.120 1.741
281 1HD1 LEU 34 1HD1 LEU 34 7.128 -4.104 4.477
282 2HD1 LEU 34 2HD1 LEU 34 8.712 -3.465 4.036
283 3HD1 LEU 34 3HD1 LEU 34 8.129 -4.964 3.309
284 1HD2 LEU 34 1HD2 LEU 34 5.249 -4.020 2.800
285 2HD2 LEU 34 2HD2 LEU 34 6.280 -4.919 1.687
286 3HD2 LEU 34 3HD2 LEU 34 5.565 -3.385 1.184
287 H VAL 35 H VAL 35 6.289 0.497 4.966
288 HA VAL 35 HA VAL 35 6.257 2.754 3.221
289 HB VAL 35 HB VAL 35 5.175 2.396 6.023
290 1HG1 VAL 35 1HG1 VAL 35 5.556 4.766 5.596
291 2HG1 VAL 35 2HG1 VAL 35 3.829 4.400 5.602
292 3HG1 VAL 35 3HG1 VAL 35 4.675 4.641 4.072
293 1HG2 VAL 35 1HG2 VAL 35 3.006 2.224 4.870
294 2HG2 VAL 35 2HG2 VAL 35 4.125 0.951 4.383
295 3HG2 VAL 35 3HG2 VAL 35 3.841 2.328 3.319
296 H GLU 36 H GLU 36 8.273 1.796 5.820
297 HA GLU 36 HA GLU 36 9.176 4.196 6.881
298 1HB GLU 36 2HB GLU 36 9.754 1.822 7.593
299 2HB GLU 36 1HB GLU 36 10.941 1.811 6.300
300 1HG GLU 36 2HG GLU 36 10.952 3.871 8.481
301 2HG GLU 36 1HG GLU 36 11.769 2.320 8.640
302 H GLU 37 H GLU 37 10.101 2.559 3.898
303 HA GLU 37 HA GLU 37 12.186 4.421 3.248
304 1HB GLU 37 2HB GLU 37 12.084 2.028 2.477
305 2HB GLU 37 1HB GLU 37 10.766 2.488 1.411
306 1HG GLU 37 2HG GLU 37 12.760 2.417 0.128
307 2HG GLU 37 1HG GLU 37 12.295 4.105 0.312
308 H PHE 38 H PHE 38 8.820 4.022 2.537
309 HA PHE 38 HA PHE 38 7.285 5.064 1.295
310 1HB PHE 38 2HB PHE 38 7.016 7.458 1.677
311 2HB PHE 38 1HB PHE 38 7.369 6.589 3.158
312 HD1 PHE 38 1HD PHE 38 8.626 9.017 0.710
313 HD2 PHE 38 2HD PHE 38 9.380 7.030 4.398
314 HE1 PHE 38 1HE PHE 38 10.389 10.656 1.227
315 HE2 PHE 38 2HE PHE 38 11.149 8.657 4.912
316 HZ PHE 38 HZ PHE 38 11.654 10.473 3.332
317 H SER 39 H SER 39 7.058 4.966 -0.750
318 HA SER 39 HA SER 39 9.062 5.739 -2.619
319 1HB SER 39 2HB SER 39 7.491 3.913 -3.100
320 2HB SER 39 1HB SER 39 6.141 5.045 -3.057
321 HG SER 39 HG SER 39 8.325 5.125 -4.883
322 H THR 40 H THR 40 6.294 7.296 -1.203
323 HA THR 40 HA THR 40 7.036 9.802 -2.427
324 HB THR 40 HB THR 40 5.519 8.798 -4.116
325 HG1 THR 40 1HG THR 40 5.200 10.891 -4.325
326 1HG2 THR 40 1HG2 THR 40 4.130 7.445 -2.634
327 2HG2 THR 40 2HG2 THR 40 3.135 8.530 -3.604
328 3HG2 THR 40 3HG2 THR 40 3.457 8.906 -1.911
329 H VAL 41 H VAL 41 4.806 11.281 -1.770
330 HA VAL 41 HA VAL 41 5.298 11.754 0.976
331 HB VAL 41 HB VAL 41 3.533 13.469 0.802
332 1HG1 VAL 41 1HG1 VAL 41 5.470 13.422 -1.506
333 2HG1 VAL 41 2HG1 VAL 41 5.801 14.008 0.123
334 3HG1 VAL 41 3HG1 VAL 41 4.634 14.851 -0.896
335 1HG2 VAL 41 1HG2 VAL 41 2.457 13.873 -1.382
336 2HG2 VAL 41 2HG2 VAL 41 1.977 12.335 -0.663
337 3HG2 VAL 41 3HG2 VAL 41 3.151 12.362 -1.976
338 H SER 42 H SER 42 3.184 12.287 2.364
339 HA SER 42 HA SER 42 2.036 9.637 2.797
340 1HB SER 42 2HB SER 42 2.057 12.052 4.625
341 2HB SER 42 1HB SER 42 1.588 10.408 5.061
342 HG SER 42 HG SER 42 4.025 11.510 5.060
343 H THR 43 H THR 43 1.031 13.038 2.674
344 HA THR 43 HA THR 43 -0.965 14.053 2.439
345 HB THR 43 HB THR 43 -1.990 11.396 1.425
346 HG1 THR 43 1HG THR 43 -0.480 11.989 -0.021
347 1HG2 THR 43 1HG2 THR 43 -3.800 12.908 2.084
348 2HG2 THR 43 2HG2 THR 43 -3.728 12.739 0.329
349 3HG2 THR 43 3HG2 THR 43 -3.091 14.190 1.103
350 H LYS 44 H LYS 44 -2.673 14.518 3.713
351 HA LYS 44 HA LYS 44 -2.371 14.215 6.320
352 1HB LYS 44 2HB LYS 44 -5.108 14.424 5.079
353 2HB LYS 44 1HB LYS 44 -4.612 15.016 6.658
354 1HG LYS 44 2HG LYS 44 -3.525 16.012 4.031
355 2HG LYS 44 1HG LYS 44 -4.799 16.795 4.963
356 1HD LYS 44 2HD LYS 44 -2.059 16.231 6.077
357 2HD LYS 44 1HD LYS 44 -2.473 17.738 5.254
358 1HE LYS 44 2HE LYS 44 -3.867 16.646 7.695
359 2HE LYS 44 1HE LYS 44 -2.638 17.911 7.709
360 1HZ LYS 44 1HZ LYS 44 -4.922 18.784 7.788
361 2HZ LYS 44 2HZ LYS 44 -5.232 18.097 6.271
362 3HZ LYS 44 3HZ LYS 44 -4.076 19.323 6.421
363 H HIS 45 H HIS 45 -4.903 12.240 4.693
364 HA HIS 45 HA HIS 45 -4.632 10.351 6.950
365 1HB HIS 45 2HB HIS 45 -7.084 11.360 5.545
366 2HB HIS 45 1HB HIS 45 -7.099 9.793 6.344
367 HD1 HIS 45 1HD HIS 45 -7.385 13.398 6.988
368 HD2 HIS 45 2HD HIS 45 -6.692 9.936 9.185
369 HE1 HIS 45 1HE HIS 45 -7.771 14.030 9.389
370 HE2 HIS 45 2HE HIS 45 -7.618 11.855 10.652
371 H LEU 46 H LEU 46 -3.497 10.480 4.095
372 HA LEU 46 HA LEU 46 -4.731 8.112 2.926
373 1HB LEU 46 2HB LEU 46 -4.143 10.083 1.524
374 2HB LEU 46 1HB LEU 46 -2.454 9.776 1.874
375 HG LEU 46 HG LEU 46 -2.635 7.577 0.757
376 1HD1 LEU 46 1HD1 LEU 46 -4.599 7.074 -0.602
377 2HD1 LEU 46 2HD1 LEU 46 -5.407 8.510 0.027
378 3HD1 LEU 46 3HD1 LEU 46 -5.014 7.174 1.111
379 1HD2 LEU 46 1HD2 LEU 46 -1.827 9.496 -0.484
380 2HD2 LEU 46 2HD2 LEU 46 -3.479 9.949 -0.897
381 3HD2 LEU 46 3HD2 LEU 46 -2.792 8.454 -1.533
382 H ARG 47 H ARG 47 -1.756 9.099 4.485
383 HA ARG 47 HA ARG 47 -0.078 7.006 3.782
384 1HB ARG 47 2HB ARG 47 0.732 8.959 4.985
385 2HB ARG 47 1HB ARG 47 -0.217 8.516 6.398
386 1HG ARG 47 2HG ARG 47 2.084 7.937 6.766
387 2HG ARG 47 1HG ARG 47 1.128 6.461 6.628
388 1HD ARG 47 2HD ARG 47 3.045 6.032 5.364
389 2HD ARG 47 1HD ARG 47 1.826 6.462 4.168
390 HE ARG 47 HE ARG 47 3.349 8.731 4.995
391 1HH1 ARG 47 1HH1 ARG 47 3.402 5.935 2.889
392 2HH1 ARG 47 2HH1 ARG 47 4.572 6.611 1.808
393 1HH2 ARG 47 1HH2 ARG 47 4.897 9.623 3.595
394 2HH2 ARG 47 2HH2 ARG 47 5.419 8.728 2.197
395 H ASN 48 H ASN 48 -2.346 7.176 6.517
396 HA ASN 48 HA ASN 48 -1.702 4.600 7.523
397 1HB ASN 48 2HB ASN 48 -4.151 6.322 7.962
398 2HB ASN 48 1HB ASN 48 -3.803 4.843 8.852
399 1HD2 ASN 48 1HD2 ASN 48 -4.093 7.606 9.797
400 2HD2 ASN 48 2HD2 ASN 48 -2.608 7.973 10.614
401 H LYS 49 H LYS 49 -3.977 5.785 5.165
402 HA LYS 49 HA LYS 49 -5.572 3.439 4.982
403 1HB LYS 49 2HB LYS 49 -5.636 6.018 3.912
404 2HB LYS 49 1HB LYS 49 -5.415 4.971 2.517
405 1HG LYS 49 2HG LYS 49 -7.620 4.758 4.556
406 2HG LYS 49 1HG LYS 49 -7.768 5.417 2.927
407 1HD LYS 49 2HD LYS 49 -7.132 3.211 2.012
408 2HD LYS 49 1HD LYS 49 -7.073 2.570 3.656
409 1HE LYS 49 2HE LYS 49 -9.494 3.725 2.278
410 2HE LYS 49 1HE LYS 49 -9.187 2.015 2.573
411 1HZ LYS 49 1HZ LYS 49 -9.535 4.090 4.669
412 2HZ LYS 49 2HZ LYS 49 -9.273 2.435 4.946
413 3HZ LYS 49 3HZ LYS 49 -10.706 2.958 4.201
414 H ILE 50 H ILE 50 -2.808 4.681 3.148
415 HA ILE 50 HA ILE 50 -2.635 2.632 1.239
416 HB ILE 50 HB ILE 50 -0.436 4.341 2.419
417 1HG1 ILE 50 2HG1 ILE 50 -2.172 5.633 1.290
418 2HG1 ILE 50 1HG1 ILE 50 -0.690 5.650 0.340
419 1HG2 ILE 50 1HG2 ILE 50 0.853 3.759 0.395
420 2HG2 ILE 50 2HG2 ILE 50 -0.396 2.590 -0.036
421 3HG2 ILE 50 3HG2 ILE 50 0.550 2.367 1.436
422 1HD1 ILE 50 1HD1 ILE 50 -2.631 5.393 -1.083
423 2HD1 ILE 50 2HD1 ILE 50 -3.121 3.955 -0.186
424 3HD1 ILE 50 3HD1 ILE 50 -1.635 3.939 -1.135
425 H ALA 51 H ALA 51 -1.088 2.963 4.415
426 HA ALA 51 HA ALA 51 0.417 0.611 4.388
427 1HB ALA 51 1HB ALA 51 0.707 2.342 6.078
428 2HB ALA 51 2HB ALA 51 0.398 0.780 6.836
429 3HB ALA 51 3HB ALA 51 -0.888 1.983 6.739
430 H GLY 52 H GLY 52 -2.896 1.193 5.510
431 1HA GLY 52 2HA GLY 52 -3.465 -1.440 6.323
432 2HA GLY 52 1HA GLY 52 -4.656 -0.236 5.850
433 H TYR 53 H TYR 53 -3.902 0.190 3.211
434 HA TYR 53 HA TYR 53 -5.255 -1.845 1.870
435 1HB TYR 53 2HB TYR 53 -4.965 0.461 1.008
436 2HB TYR 53 1HB TYR 53 -3.267 0.115 0.704
437 HD1 TYR 53 1HD TYR 53 -2.653 -0.569 -1.427
438 HD2 TYR 53 2HD TYR 53 -6.659 -1.213 -0.147
439 HE1 TYR 53 1HE TYR 53 -3.228 -1.400 -3.672
440 HE2 TYR 53 2HE TYR 53 -7.247 -2.052 -2.386
441 HH TYR 53 HH TYR 53 -4.963 -2.919 -4.689
442 H ILE 54 H ILE 54 -1.788 -1.315 2.318
443 HA ILE 54 HA ILE 54 -0.792 -3.355 0.708
444 HB ILE 54 HB ILE 54 0.297 -2.351 3.342
445 1HG1 ILE 54 2HG1 ILE 54 1.014 -1.636 0.493
446 2HG1 ILE 54 1HG1 ILE 54 0.065 -0.631 1.583
447 1HG2 ILE 54 1HG2 ILE 54 2.445 -3.289 2.625
448 2HG2 ILE 54 2HG2 ILE 54 1.666 -3.985 1.206
449 3HG2 ILE 54 3HG2 ILE 54 1.222 -4.544 2.818
450 1HD1 ILE 54 1HD1 ILE 54 2.331 0.173 1.475
451 2HD1 ILE 54 2HD1 ILE 54 2.950 -1.418 1.922
452 3HD1 ILE 54 3HD1 ILE 54 2.011 -0.480 3.082
453 H THR 55 H THR 55 -1.575 -3.506 4.209
454 HA THR 55 HA THR 55 -1.073 -6.260 4.460
455 HB THR 55 HB THR 55 -2.795 -5.988 6.443
456 HG1 THR 55 1HG THR 55 -3.297 -3.778 5.439
457 1HG2 THR 55 1HG2 THR 55 -0.108 -4.619 6.352
458 2HG2 THR 55 2HG2 THR 55 -0.397 -6.325 6.696
459 3HG2 THR 55 3HG2 THR 55 -0.968 -5.091 7.818
460 H ARG 56 H ARG 56 -3.984 -4.523 3.491
461 HA ARG 56 HA ARG 56 -5.789 -6.676 3.716
462 1HB ARG 56 2HB ARG 56 -5.891 -4.356 1.777
463 2HB ARG 56 1HB ARG 56 -7.226 -5.432 2.153
464 1HG ARG 56 2HG ARG 56 -5.892 -3.485 4.017
465 2HG ARG 56 1HG ARG 56 -7.512 -3.367 3.333
466 1HD ARG 56 2HD ARG 56 -6.523 -5.431 5.299
467 2HD ARG 56 1HD ARG 56 -7.639 -4.110 5.633
468 HE ARG 56 HE ARG 56 -8.252 -6.649 4.447
469 1HH1 ARG 56 1HH1 ARG 56 -9.240 -3.296 4.665
470 2HH1 ARG 56 2HH1 ARG 56 -10.905 -3.623 4.275
471 1HH2 ARG 56 1HH2 ARG 56 -10.426 -7.091 3.934
472 2HH2 ARG 56 2HH2 ARG 56 -11.579 -5.793 3.850
473 H ILE 57 H ILE 57 -3.731 -5.578 1.050
474 HA ILE 57 HA ILE 57 -4.588 -7.382 -0.916
475 HB ILE 57 HB ILE 57 -1.804 -6.273 -0.490
476 1HG1 ILE 57 2HG1 ILE 57 -4.041 -5.298 -2.284
477 2HG1 ILE 57 1HG1 ILE 57 -3.562 -4.548 -0.765
478 1HG2 ILE 57 1HG2 ILE 57 -1.441 -6.760 -2.867
479 2HG2 ILE 57 2HG2 ILE 57 -3.032 -7.518 -2.951
480 3HG2 ILE 57 3HG2 ILE 57 -1.769 -8.229 -1.945
481 1HD1 ILE 57 1HD1 ILE 57 -2.655 -3.349 -2.667
482 2HD1 ILE 57 2HD1 ILE 57 -1.839 -4.813 -3.217
483 3HD1 ILE 57 3HD1 ILE 57 -1.365 -4.056 -1.696
484 H ILE 58 H ILE 58 -2.055 -7.699 1.548
485 HA ILE 58 HA ILE 58 -1.070 -10.205 0.802
486 HB ILE 58 HB ILE 58 -1.257 -9.058 3.592
487 1HG1 ILE 58 2HG1 ILE 58 0.982 -8.898 1.563
488 2HG1 ILE 58 1HG1 ILE 58 -0.127 -7.584 1.941
489 1HG2 ILE 58 1HG2 ILE 58 -0.781 -11.452 3.597
490 2HG2 ILE 58 2HG2 ILE 58 0.631 -10.527 4.103
491 3HG2 ILE 58 3HG2 ILE 58 0.555 -11.198 2.474
492 1HD1 ILE 58 1HD1 ILE 58 1.841 -8.855 3.828
493 2HD1 ILE 58 2HD1 ILE 58 0.707 -7.569 4.245
494 3HD1 ILE 58 3HD1 ILE 58 1.985 -7.271 3.066
495 H SER 59 H SER 59 -3.616 -9.392 3.151
496 HA SER 59 HA SER 59 -4.262 -12.054 3.819
497 1HB SER 59 2HB SER 59 -6.025 -9.597 3.973
498 2HB SER 59 1HB SER 59 -6.255 -11.107 4.859
499 HG SER 59 HG SER 59 -4.897 -9.045 5.666
500 H GLN 60 H GLN 60 -5.430 -9.900 1.284
501 HA GLN 60 HA GLN 60 -7.708 -11.474 0.617
502 1HB GLN 60 2HB GLN 60 -7.398 -9.012 0.151
503 2HB GLN 60 1HB GLN 60 -6.313 -9.465 -1.154
504 1HG GLN 60 2HG GLN 60 -8.545 -8.958 -1.977
505 2HG GLN 60 1HG GLN 60 -8.116 -10.642 -2.276
506 1HE2 GLN 60 1HE2 GLN 60 -10.285 -11.206 -2.469
507 2HE2 GLN 60 2HE2 GLN 60 -11.315 -11.352 -1.080
508 H GLN 61 H GLN 61 -4.364 -11.580 -0.302
509 HA GLN 61 HA GLN 61 -4.711 -13.105 -2.691
510 1HB GLN 61 2HB GLN 61 -2.307 -12.729 -0.903
511 2HB GLN 61 1HB GLN 61 -2.268 -13.607 -2.424
512 1HG GLN 61 2HG GLN 61 -2.943 -11.579 -3.609
513 2HG GLN 61 1HG GLN 61 -2.969 -10.700 -2.079
514 1HE2 GLN 61 1HE2 GLN 61 -1.031 -10.237 -1.046
515 2HE2 GLN 61 2HE2 GLN 61 0.492 -10.314 -1.862
516 H LYS 62 H LYS 62 -4.851 -13.876 0.634
517 HA LYS 62 HA LYS 62 -4.331 -16.705 0.128
518 1HB LYS 62 2HB LYS 62 -3.341 -15.586 2.139
519 2HB LYS 62 1HB LYS 62 -4.972 -15.348 2.753
520 1HG LYS 62 2HG LYS 62 -5.314 -17.746 2.846
521 2HG LYS 62 1HG LYS 62 -3.712 -18.018 2.161
522 1HD LYS 62 2HD LYS 62 -3.620 -18.337 4.549
523 2HD LYS 62 1HD LYS 62 -2.725 -16.876 4.121
524 1HE LYS 62 2HE LYS 62 -4.656 -15.512 4.760
525 2HE LYS 62 1HE LYS 62 -5.543 -16.974 5.194
526 1HZ LYS 62 1HZ LYS 62 -3.006 -16.875 6.492
527 2HZ LYS 62 2HZ LYS 62 -4.560 -17.024 7.166
528 3HZ LYS 62 3HZ LYS 62 -3.921 -15.489 6.833
Start of MODEL 10
1 1H MET 1 1HT MET 1 -19.539 1.835 -15.433
2 2H MET 1 2HT MET 1 -19.485 0.781 -14.103
3 3H MET 1 3HT MET 1 -18.821 0.307 -15.590
4 HA MET 1 HA MET 1 -17.157 2.045 -15.428
5 1HB MET 1 2HB MET 1 -18.408 2.486 -12.706
6 2HB MET 1 1HB MET 1 -16.870 3.171 -13.219
7 1HG MET 1 2HG MET 1 -18.022 4.386 -15.006
8 2HG MET 1 1HG MET 1 -19.558 3.712 -14.463
9 1HE MET 1 1HE MET 1 -20.610 6.102 -14.292
10 2HE MET 1 2HE MET 1 -19.102 6.818 -14.859
11 3HE MET 1 3HE MET 1 -19.887 7.444 -13.407
12 H GLY 2 H GLY 2 -15.131 1.672 -14.260
13 1HA GLY 2 2HA GLY 2 -15.074 -1.111 -13.291
14 2HA GLY 2 1HA GLY 2 -13.728 -0.267 -14.040
15 H ASN 3 H ASN 3 -12.158 0.048 -12.647
16 HA ASN 3 HA ASN 3 -12.858 0.643 -9.845
17 1HB ASN 3 2HB ASN 3 -11.683 -1.542 -10.279
18 2HB ASN 3 1HB ASN 3 -10.306 -0.622 -10.876
19 1HD2 ASN 3 1HD2 ASN 3 -8.929 -1.407 -9.301
20 2HD2 ASN 3 2HD2 ASN 3 -9.054 -0.937 -7.640
21 H ILE 4 H ILE 4 -12.605 2.543 -12.065
22 HA ILE 4 HA ILE 4 -10.114 3.898 -11.845
23 HB ILE 4 HB ILE 4 -11.638 4.155 -13.792
24 1HG1 ILE 4 2HG1 ILE 4 -11.070 6.779 -12.396
25 2HG1 ILE 4 1HG1 ILE 4 -9.862 5.826 -13.250
26 1HG2 ILE 4 1HG2 ILE 4 -13.319 5.773 -11.886
27 2HG2 ILE 4 2HG2 ILE 4 -13.756 4.226 -12.616
28 3HG2 ILE 4 3HG2 ILE 4 -13.566 5.658 -13.629
29 1HD1 ILE 4 1HD1 ILE 4 -10.639 7.642 -14.631
30 2HD1 ILE 4 2HD1 ILE 4 -12.306 7.095 -14.454
31 3HD1 ILE 4 3HD1 ILE 4 -11.138 6.099 -15.324
32 H ARG 5 H ARG 5 -9.659 5.869 -10.769
33 HA ARG 5 HA ARG 5 -9.675 7.385 -9.073
34 1HB ARG 5 2HB ARG 5 -12.110 7.722 -9.749
35 2HB ARG 5 1HB ARG 5 -12.530 6.610 -8.455
36 1HG ARG 5 2HG ARG 5 -11.376 8.139 -6.859
37 2HG ARG 5 1HG ARG 5 -11.175 9.283 -8.188
38 1HD ARG 5 2HD ARG 5 -13.783 8.239 -7.093
39 2HD ARG 5 1HD ARG 5 -13.128 9.861 -6.869
40 HE ARG 5 HE ARG 5 -13.260 9.857 -9.479
41 1HH1 ARG 5 1HH1 ARG 5 -15.572 8.525 -7.206
42 2HH1 ARG 5 2HH1 ARG 5 -16.925 8.707 -8.282
43 1HH2 ARG 5 1HH2 ARG 5 -15.042 10.110 -10.888
44 2HH2 ARG 5 2HH2 ARG 5 -16.628 9.598 -10.383
45 H THR 6 H THR 6 -9.168 4.483 -8.873
46 HA THR 6 HA THR 6 -8.637 4.381 -6.060
47 HB THR 6 HB THR 6 -9.767 1.921 -6.161
48 HG1 THR 6 1HG THR 6 -11.248 1.840 -7.649
49 1HG2 THR 6 1HG2 THR 6 -11.592 2.835 -4.798
50 2HG2 THR 6 2HG2 THR 6 -11.153 4.464 -5.312
51 3HG2 THR 6 3HG2 THR 6 -10.030 3.514 -4.340
52 H SER 7 H SER 7 -8.635 2.823 -9.223
53 HA SER 7 HA SER 7 -6.599 0.957 -8.768
54 1HB SER 7 2HB SER 7 -7.209 2.542 -11.279
55 2HB SER 7 1HB SER 7 -6.163 1.124 -11.208
56 HG SER 7 HG SER 7 -8.922 1.198 -10.525
57 H PHE 8 H PHE 8 -6.532 4.409 -9.194
58 HA PHE 8 HA PHE 8 -3.811 4.835 -9.653
59 1HB PHE 8 2HB PHE 8 -5.457 6.625 -9.826
60 2HB PHE 8 1HB PHE 8 -5.805 6.508 -8.105
61 HD1 PHE 8 1HD PHE 8 -4.585 7.753 -6.556
62 HD2 PHE 8 2HD PHE 8 -3.137 7.350 -10.536
63 HE1 PHE 8 1HE PHE 8 -2.860 9.445 -6.094
64 HE2 PHE 8 2HE PHE 8 -1.408 9.040 -10.080
65 HZ PHE 8 HZ PHE 8 -1.267 10.088 -7.859
66 H VAL 9 H VAL 9 -5.595 4.587 -6.586
67 HA VAL 9 HA VAL 9 -3.337 4.924 -4.911
68 HB VAL 9 HB VAL 9 -5.914 3.473 -4.276
69 1HG1 VAL 9 1HG1 VAL 9 -5.412 4.058 -1.950
70 2HG1 VAL 9 2HG1 VAL 9 -3.877 4.762 -2.461
71 3HG1 VAL 9 3HG1 VAL 9 -4.160 3.031 -2.647
72 1HG2 VAL 9 1HG2 VAL 9 -6.692 5.605 -3.367
73 2HG2 VAL 9 2HG2 VAL 9 -6.361 5.717 -5.097
74 3HG2 VAL 9 3HG2 VAL 9 -5.215 6.383 -3.933
75 H LYS 10 H LYS 10 -4.989 2.111 -6.228
76 HA LYS 10 HA LYS 10 -3.491 0.098 -4.985
77 1HB LYS 10 2HB LYS 10 -5.577 -0.344 -6.162
78 2HB LYS 10 1HB LYS 10 -4.850 0.138 -7.687
79 1HG LYS 10 2HG LYS 10 -3.393 -1.773 -7.656
80 2HG LYS 10 1HG LYS 10 -3.964 -2.227 -6.047
81 1HD LYS 10 2HD LYS 10 -6.161 -2.682 -6.883
82 2HD LYS 10 1HD LYS 10 -5.749 -2.020 -8.465
83 1HE LYS 10 2HE LYS 10 -4.430 -4.435 -7.237
84 2HE LYS 10 1HE LYS 10 -5.777 -4.510 -8.371
85 1HZ LYS 10 1HZ LYS 10 -3.093 -3.353 -8.915
86 2HZ LYS 10 2HZ LYS 10 -4.395 -3.349 -10.000
87 3HZ LYS 10 3HZ LYS 10 -3.699 -4.820 -9.521
88 H ARG 11 H ARG 11 -2.831 2.090 -7.806
89 HA ARG 11 HA ARG 11 -0.586 0.614 -8.731
90 1HB ARG 11 2HB ARG 11 -1.836 2.263 -10.123
91 2HB ARG 11 1HB ARG 11 -1.157 3.556 -9.138
92 1HG ARG 11 2HG ARG 11 1.120 2.640 -9.782
93 2HG ARG 11 1HG ARG 11 0.272 1.682 -10.993
94 1HD ARG 11 2HD ARG 11 -0.610 3.717 -11.999
95 2HD ARG 11 1HD ARG 11 0.198 4.688 -10.764
96 HE ARG 11 HE ARG 11 1.707 2.961 -12.630
97 1HH1 ARG 11 1HH1 ARG 11 1.138 6.064 -11.123
98 2HH1 ARG 11 2HH1 ARG 11 2.588 6.790 -11.741
99 1HH2 ARG 11 1HH2 ARG 11 3.598 3.907 -13.489
100 2HH2 ARG 11 2HH2 ARG 11 3.998 5.548 -13.094
101 H ILE 12 H ILE 12 -0.996 3.254 -6.423
102 HA ILE 12 HA ILE 12 1.724 3.897 -6.072
103 HB ILE 12 HB ILE 12 -0.341 4.008 -3.869
104 1HG1 ILE 12 2HG1 ILE 12 0.235 6.088 -5.997
105 2HG1 ILE 12 1HG1 ILE 12 -1.205 5.077 -5.948
106 1HG2 ILE 12 1HG2 ILE 12 1.016 5.888 -3.082
107 2HG2 ILE 12 2HG2 ILE 12 2.132 5.638 -4.425
108 3HG2 ILE 12 3HG2 ILE 12 1.957 4.398 -3.181
109 1HD1 ILE 12 1HD1 ILE 12 -1.865 6.100 -3.845
110 2HD1 ILE 12 2HD1 ILE 12 -1.638 7.316 -5.103
111 3HD1 ILE 12 3HD1 ILE 12 -0.405 7.093 -3.862
112 H ALA 13 H ALA 13 -0.356 1.497 -4.548
113 HA ALA 13 HA ALA 13 1.528 0.517 -2.687
114 1HB ALA 13 1HB ALA 13 -0.856 0.075 -2.483
115 2HB ALA 13 2HB ALA 13 0.060 -1.431 -2.519
116 3HB ALA 13 3HB ALA 13 -0.815 -0.896 -3.954
117 H LYS 14 H LYS 14 0.860 -0.263 -6.046
118 HA LYS 14 HA LYS 14 2.471 -2.565 -6.241
119 1HB LYS 14 2HB LYS 14 0.839 -2.009 -7.961
120 2HB LYS 14 1HB LYS 14 1.720 -0.538 -8.358
121 1HG LYS 14 2HG LYS 14 3.688 -2.055 -8.903
122 2HG LYS 14 1HG LYS 14 2.530 -3.385 -8.839
123 1HD LYS 14 2HD LYS 14 1.236 -2.421 -10.614
124 2HD LYS 14 1HD LYS 14 2.219 -0.955 -10.596
125 1HE LYS 14 2HE LYS 14 3.083 -3.727 -11.399
126 2HE LYS 14 1HE LYS 14 2.910 -2.320 -12.446
127 1HZ LYS 14 1HZ LYS 14 4.950 -2.807 -10.357
128 2HZ LYS 14 2HZ LYS 14 4.659 -1.254 -10.978
129 3HZ LYS 14 3HZ LYS 14 5.187 -2.498 -12.007
130 H GLU 15 H GLU 15 3.167 0.801 -7.222
131 HA GLU 15 HA GLU 15 5.908 0.291 -7.756
132 1HB GLU 15 2HB GLU 15 4.176 2.687 -7.629
133 2HB GLU 15 1HB GLU 15 5.895 2.959 -7.376
134 1HG GLU 15 2HG GLU 15 5.286 3.268 -9.703
135 2HG GLU 15 1HG GLU 15 6.398 1.917 -9.510
136 H MET 16 H MET 16 4.194 0.783 -4.871
137 HA MET 16 HA MET 16 6.236 1.813 -3.210
138 1HB MET 16 2HB MET 16 3.678 1.375 -2.775
139 2HB MET 16 1HB MET 16 4.235 -0.204 -2.249
140 1HG MET 16 2HG MET 16 4.015 1.179 -0.336
141 2HG MET 16 1HG MET 16 5.735 0.928 -0.633
142 1HE MET 16 1HE MET 16 4.259 3.277 1.182
143 2HE MET 16 2HE MET 16 5.383 4.594 0.850
144 3HE MET 16 3HE MET 16 5.995 2.966 1.150
145 H ILE 17 H ILE 17 5.141 -1.516 -3.830
146 HA ILE 17 HA ILE 17 7.353 -2.701 -2.446
147 HB ILE 17 HB ILE 17 5.437 -4.020 -4.378
148 1HG1 ILE 17 2HG1 ILE 17 5.248 -3.761 -1.366
149 2HG1 ILE 17 1HG1 ILE 17 4.273 -2.857 -2.521
150 1HG2 ILE 17 1HG2 ILE 17 7.457 -5.322 -3.901
151 2HG2 ILE 17 2HG2 ILE 17 6.023 -6.081 -3.210
152 3HG2 ILE 17 3HG2 ILE 17 7.134 -5.187 -2.172
153 1HD1 ILE 17 1HD1 ILE 17 4.267 -5.848 -2.192
154 2HD1 ILE 17 2HD1 ILE 17 3.264 -4.918 -3.308
155 3HD1 ILE 17 3HD1 ILE 17 3.052 -4.733 -1.566
156 H GLU 18 H GLU 18 6.647 -1.784 -5.730
157 HA GLU 18 HA GLU 18 8.599 -3.252 -7.096
158 1HB GLU 18 2HB GLU 18 6.774 -1.991 -8.187
159 2HB GLU 18 1HB GLU 18 7.544 -0.482 -7.718
160 1HG GLU 18 2HG GLU 18 7.922 -1.084 -10.071
161 2HG GLU 18 1HG GLU 18 9.417 -0.930 -9.149
162 H THR 19 H THR 19 10.635 -2.566 -7.924
163 HA THR 19 HA THR 19 12.706 -1.619 -7.855
164 HB THR 19 HB THR 19 11.658 0.249 -5.717
165 HG1 THR 19 1HG THR 19 10.648 1.010 -7.437
166 1HG2 THR 19 1HG2 THR 19 14.102 0.013 -5.676
167 2HG2 THR 19 2HG2 THR 19 13.623 1.611 -6.252
168 3HG2 THR 19 3HG2 THR 19 14.168 0.386 -7.399
169 H HIS 20 H HIS 20 11.193 -2.041 -4.654
170 HA HIS 20 HA HIS 20 13.382 -3.814 -3.925
171 1HB HIS 20 2HB HIS 20 14.180 -1.622 -3.182
172 2HB HIS 20 1HB HIS 20 12.682 -1.360 -2.299
173 HD1 HIS 20 1HD HIS 20 15.993 -3.015 -2.069
174 HD2 HIS 20 2HD HIS 20 12.443 -2.879 0.100
175 HE1 HIS 20 1HE HIS 20 16.532 -3.991 0.186
176 HE2 HIS 20 2HE HIS 20 14.430 -3.673 1.550
177 HA PRO 21 HA PRO 21 9.466 -5.519 -2.319
178 1HB PRO 21 2HB PRO 21 10.837 -8.076 -2.656
179 2HB PRO 21 1HB PRO 21 9.345 -7.510 -3.409
180 1HG PRO 21 2HG PRO 21 11.648 -7.852 -4.795
181 2HG PRO 21 1HG PRO 21 10.444 -6.622 -5.222
182 1HD PRO 21 2HD PRO 21 13.025 -6.316 -3.730
183 2HD PRO 21 1HD PRO 21 12.311 -5.265 -4.972
184 H GLY 22 H GLY 22 9.815 -4.798 -0.217
185 1HA GLY 22 2HA GLY 22 11.956 -5.648 1.429
186 2HA GLY 22 1HA GLY 22 10.500 -4.829 1.970
187 H LYS 23 H LYS 23 8.604 -6.130 2.393
188 HA LYS 23 HA LYS 23 9.168 -8.958 2.932
189 1HB LYS 23 2HB LYS 23 8.038 -6.977 4.922
190 2HB LYS 23 1HB LYS 23 8.017 -8.717 5.146
191 1HG LYS 23 2HG LYS 23 10.422 -8.790 5.208
192 2HG LYS 23 1HG LYS 23 10.512 -7.066 4.836
193 1HD LYS 23 2HD LYS 23 9.451 -6.513 6.931
194 2HD LYS 23 1HD LYS 23 9.182 -8.220 7.286
195 1HE LYS 23 2HE LYS 23 11.902 -6.974 6.936
196 2HE LYS 23 1HE LYS 23 11.115 -7.199 8.496
197 1HZ LYS 23 1HZ LYS 23 12.725 -8.971 7.855
198 2HZ LYS 23 2HZ LYS 23 11.663 -9.431 6.617
199 3HZ LYS 23 3HZ LYS 23 11.174 -9.535 8.235
200 H PHE 24 H PHE 24 7.323 -10.290 3.038
201 HA PHE 24 HA PHE 24 4.825 -9.028 2.106
202 1HB PHE 24 2HB PHE 24 6.033 -10.608 0.494
203 2HB PHE 24 1HB PHE 24 5.623 -11.902 1.612
204 HD1 PHE 24 1HD PHE 24 4.066 -9.179 -0.386
205 HD2 PHE 24 2HD PHE 24 3.616 -13.030 1.368
206 HE1 PHE 24 1HE PHE 24 1.893 -9.433 -1.511
207 HE2 PHE 24 2HE PHE 24 1.442 -13.292 0.247
208 HZ PHE 24 HZ PHE 24 0.578 -11.490 -1.196
209 H THR 25 H THR 25 4.861 -8.785 4.598
210 HA THR 25 HA THR 25 3.576 -11.144 5.812
211 HB THR 25 HB THR 25 5.201 -9.052 7.280
212 HG1 THR 25 1HG THR 25 5.916 -11.467 6.033
213 1HG2 THR 25 1HG2 THR 25 5.161 -10.687 9.112
214 2HG2 THR 25 2HG2 THR 25 4.154 -11.755 8.133
215 3HG2 THR 25 3HG2 THR 25 3.530 -10.192 8.657
216 H ASP 26 H ASP 26 1.627 -10.815 6.804
217 HA ASP 26 HA ASP 26 0.363 -8.269 6.216
218 1HB ASP 26 2HB ASP 26 -1.746 -9.440 6.709
219 2HB ASP 26 1HB ASP 26 -0.777 -10.297 5.518
220 H ASP 27 H ASP 27 2.230 -8.393 8.456
221 HA ASP 27 HA ASP 27 0.462 -7.914 10.741
222 1HB ASP 27 2HB ASP 27 2.664 -9.202 10.948
223 2HB ASP 27 1HB ASP 27 3.473 -7.660 10.702
224 H PHE 28 H PHE 28 0.275 -5.871 11.715
225 HA PHE 28 HA PHE 28 0.480 -3.646 9.973
226 1HB PHE 28 2HB PHE 28 -0.162 -3.906 12.904
227 2HB PHE 28 1HB PHE 28 -0.060 -2.334 12.116
228 HD1 PHE 28 1HD PHE 28 -1.895 -5.523 12.217
229 HD2 PHE 28 2HD PHE 28 -1.780 -1.559 10.682
230 HE1 PHE 28 1HE PHE 28 -4.227 -5.750 11.464
231 HE2 PHE 28 2HE PHE 28 -4.107 -1.777 9.923
232 HZ PHE 28 HZ PHE 28 -5.334 -3.873 10.312
233 H ASP 29 H ASP 29 2.593 -4.981 12.408
234 HA ASP 29 HA ASP 29 4.335 -2.752 12.656
235 1HB ASP 29 2HB ASP 29 4.416 -4.646 14.223
236 2HB ASP 29 1HB ASP 29 4.931 -5.710 12.920
237 H THR 30 H THR 30 4.072 -5.430 10.432
238 HA THR 30 HA THR 30 6.487 -5.026 9.044
239 HB THR 30 HB THR 30 3.960 -6.267 7.948
240 HG1 THR 30 1HG THR 30 5.731 -7.098 9.905
241 1HG2 THR 30 1HG2 THR 30 6.876 -6.700 7.286
242 2HG2 THR 30 2HG2 THR 30 5.711 -5.832 6.286
243 3HG2 THR 30 3HG2 THR 30 5.517 -7.563 6.569
244 H ASN 31 H ASN 31 3.117 -4.096 8.162
245 HA ASN 31 HA ASN 31 3.902 -2.832 5.771
246 1HB ASN 31 2HB ASN 31 1.672 -1.894 5.642
247 2HB ASN 31 1HB ASN 31 1.580 -3.563 6.171
248 1HD2 ASN 31 1HD2 ASN 31 -0.438 -3.329 7.055
249 2HD2 ASN 31 2HD2 ASN 31 -0.732 -2.426 8.497
250 H LYS 32 H LYS 32 3.830 -1.709 9.032
251 HA LYS 32 HA LYS 32 3.997 1.065 8.572
252 1HB LYS 32 2HB LYS 32 3.460 -0.018 10.738
253 2HB LYS 32 1HB LYS 32 5.118 -0.585 10.846
254 1HG LYS 32 2HG LYS 32 5.925 1.672 11.039
255 2HG LYS 32 1HG LYS 32 4.299 2.313 10.782
256 1HD LYS 32 2HD LYS 32 3.539 1.185 12.822
257 2HD LYS 32 1HD LYS 32 5.167 0.557 13.079
258 1HE LYS 32 2HE LYS 32 6.023 2.809 13.333
259 2HE LYS 32 1HE LYS 32 4.429 3.477 12.985
260 1HZ LYS 32 1HZ LYS 32 3.573 2.507 14.979
261 2HZ LYS 32 2HZ LYS 32 4.967 3.393 15.377
262 3HZ LYS 32 3HZ LYS 32 5.031 1.697 15.287
263 H LYS 33 H LYS 33 6.486 -1.408 9.111
264 HA LYS 33 HA LYS 33 8.647 0.422 8.642
265 1HB LYS 33 2HB LYS 33 8.562 -2.584 8.918
266 2HB LYS 33 1HB LYS 33 10.046 -1.647 8.761
267 1HG LYS 33 2HG LYS 33 9.701 -0.573 10.832
268 2HG LYS 33 1HG LYS 33 8.036 -1.145 10.932
269 1HD LYS 33 2HD LYS 33 8.862 -3.453 11.127
270 2HD LYS 33 1HD LYS 33 10.521 -2.849 11.079
271 1HE LYS 33 2HE LYS 33 10.260 -1.708 13.136
272 2HE LYS 33 1HE LYS 33 8.513 -1.931 13.122
273 1HZ LYS 33 1HZ LYS 33 10.542 -4.079 13.442
274 2HZ LYS 33 2HZ LYS 33 8.860 -4.314 13.386
275 3HZ LYS 33 3HZ LYS 33 9.554 -3.441 14.660
276 H LEU 34 H LEU 34 6.669 -1.636 6.702
277 HA LEU 34 HA LEU 34 8.352 -1.850 4.441
278 1HB LEU 34 2HB LEU 34 5.350 -1.885 4.708
279 2HB LEU 34 1HB LEU 34 6.173 -2.127 3.181
280 HG LEU 34 HG LEU 34 6.333 -3.898 5.618
281 1HD1 LEU 34 1HD1 LEU 34 4.279 -4.112 4.304
282 2HD1 LEU 34 2HD1 LEU 34 5.289 -5.551 4.169
283 3HD1 LEU 34 3HD1 LEU 34 5.239 -4.383 2.850
284 1HD2 LEU 34 1HD2 LEU 34 7.783 -4.101 2.982
285 2HD2 LEU 34 2HD2 LEU 34 7.746 -5.348 4.227
286 3HD2 LEU 34 3HD2 LEU 34 8.508 -3.795 4.561
287 H VAL 35 H VAL 35 5.751 0.453 5.241
288 HA VAL 35 HA VAL 35 6.020 2.131 3.030
289 HB VAL 35 HB VAL 35 5.245 2.834 5.870
290 1HG1 VAL 35 1HG1 VAL 35 5.994 4.833 4.663
291 2HG1 VAL 35 2HG1 VAL 35 4.257 4.872 4.956
292 3HG1 VAL 35 3HG1 VAL 35 4.872 4.462 3.353
293 1HG2 VAL 35 1HG2 VAL 35 3.776 1.207 4.807
294 2HG2 VAL 35 2HG2 VAL 35 3.583 2.273 3.415
295 3HG2 VAL 35 3HG2 VAL 35 2.957 2.758 4.991
296 H GLU 36 H GLU 36 7.681 2.159 6.137
297 HA GLU 36 HA GLU 36 9.283 4.414 5.812
298 1HB GLU 36 2HB GLU 36 9.017 3.209 7.924
299 2HB GLU 36 1HB GLU 36 9.867 1.823 7.256
300 1HG GLU 36 2HG GLU 36 11.859 3.348 6.964
301 2HG GLU 36 1HG GLU 36 10.980 4.525 7.943
302 H GLU 37 H GLU 37 9.808 1.074 4.765
303 HA GLU 37 HA GLU 37 12.496 1.602 3.876
304 1HB GLU 37 2HB GLU 37 12.065 -0.567 4.777
305 2HB GLU 37 1HB GLU 37 10.719 -0.823 3.676
306 1HG GLU 37 2HG GLU 37 12.205 -0.945 1.797
307 2HG GLU 37 1HG GLU 37 13.583 -0.518 2.810
308 H PHE 38 H PHE 38 9.395 0.910 2.291
309 HA PHE 38 HA PHE 38 10.356 0.543 -0.296
310 1HB PHE 38 2HB PHE 38 7.668 1.467 0.707
311 2HB PHE 38 1HB PHE 38 7.992 1.144 -0.992
312 HD1 PHE 38 1HD PHE 38 5.916 -0.226 0.725
313 HD2 PHE 38 2HD PHE 38 9.948 -1.222 -0.194
314 HE1 PHE 38 1HE PHE 38 5.403 -2.606 1.067
315 HE2 PHE 38 2HE PHE 38 9.441 -3.603 0.147
316 HZ PHE 38 HZ PHE 38 7.166 -4.299 0.777
317 H SER 39 H SER 39 8.386 3.382 0.518
318 HA SER 39 HA SER 39 10.322 5.043 -0.924
319 1HB SER 39 2HB SER 39 8.309 4.428 -2.346
320 2HB SER 39 1HB SER 39 7.332 5.365 -1.216
321 HG SER 39 HG SER 39 9.521 6.321 -2.756
322 H THR 40 H THR 40 10.757 6.961 0.003
323 HA THR 40 HA THR 40 9.818 7.295 2.713
324 HB THR 40 HB THR 40 12.204 7.583 2.170
325 HG1 THR 40 1HG THR 40 10.726 9.743 3.243
326 1HG2 THR 40 1HG2 THR 40 12.960 9.603 0.991
327 2HG2 THR 40 2HG2 THR 40 11.282 10.027 0.647
328 3HG2 THR 40 3HG2 THR 40 11.985 8.570 -0.055
329 H VAL 41 H VAL 41 8.551 8.237 -0.170
330 HA VAL 41 HA VAL 41 7.891 10.945 0.323
331 HB VAL 41 HB VAL 41 7.757 10.071 -1.933
332 1HG1 VAL 41 1HG1 VAL 41 7.073 7.793 -1.482
333 2HG1 VAL 41 2HG1 VAL 41 5.965 8.544 -2.631
334 3HG1 VAL 41 3HG1 VAL 41 5.488 8.349 -0.944
335 1HG2 VAL 41 1HG2 VAL 41 5.542 10.937 -2.573
336 2HG2 VAL 41 2HG2 VAL 41 6.377 11.982 -1.423
337 3HG2 VAL 41 3HG2 VAL 41 5.071 10.930 -0.872
338 H SER 42 H SER 42 6.788 11.634 1.978
339 HA SER 42 HA SER 42 5.027 9.885 3.443
340 1HB SER 42 2HB SER 42 5.682 12.808 3.899
341 2HB SER 42 1HB SER 42 4.910 11.718 5.052
342 HG SER 42 HG SER 42 7.394 11.016 3.954
343 H THR 43 H THR 43 2.849 10.612 4.107
344 HA THR 43 HA THR 43 1.503 12.456 2.305
345 HB THR 43 HB THR 43 0.479 9.617 2.533
346 HG1 THR 43 1HG THR 43 2.405 10.711 0.876
347 1HG2 THR 43 1HG2 THR 43 -1.237 11.264 2.041
348 2HG2 THR 43 2HG2 THR 43 -0.911 10.306 0.597
349 3HG2 THR 43 3HG2 THR 43 -0.257 11.938 0.741
350 H LYS 44 H LYS 44 0.232 13.644 3.508
351 HA LYS 44 HA LYS 44 0.262 14.028 6.051
352 1HB LYS 44 2HB LYS 44 -1.134 15.283 4.438
353 2HB LYS 44 1HB LYS 44 -2.389 14.067 4.619
354 1HG LYS 44 2HG LYS 44 -2.873 14.713 6.800
355 2HG LYS 44 1HG LYS 44 -1.335 15.556 6.990
356 1HD LYS 44 2HD LYS 44 -3.194 17.130 6.736
357 2HD LYS 44 1HD LYS 44 -2.047 17.257 5.401
358 1HE LYS 44 2HE LYS 44 -3.546 15.814 4.046
359 2HE LYS 44 1HE LYS 44 -4.709 15.838 5.373
360 1HZ LYS 44 1HZ LYS 44 -4.779 18.279 5.154
361 2HZ LYS 44 2HZ LYS 44 -5.314 17.481 3.762
362 3HZ LYS 44 3HZ LYS 44 -3.769 18.177 3.797
363 H HIS 45 H HIS 45 -2.790 12.329 5.305
364 HA HIS 45 HA HIS 45 -2.055 10.366 7.366
365 1HB HIS 45 2HB HIS 45 -4.571 12.003 7.256
366 2HB HIS 45 1HB HIS 45 -4.560 10.422 8.028
367 HD1 HIS 45 1HD HIS 45 -4.842 13.414 9.336
368 HD2 HIS 45 2HD HIS 45 -1.651 10.762 9.588
369 HE1 HIS 45 1HE HIS 45 -3.572 14.074 11.407
370 HE2 HIS 45 2HE HIS 45 -1.636 12.461 11.537
371 H LEU 46 H LEU 46 -2.477 10.591 4.300
372 HA LEU 46 HA LEU 46 -4.451 8.501 3.893
373 1HB LEU 46 2HB LEU 46 -4.312 10.386 2.313
374 2HB LEU 46 1HB LEU 46 -2.665 9.930 1.920
375 HG LEU 46 HG LEU 46 -3.507 7.774 1.026
376 1HD1 LEU 46 1HD1 LEU 46 -6.217 9.001 1.502
377 2HD1 LEU 46 2HD1 LEU 46 -5.546 7.597 2.329
378 3HD1 LEU 46 3HD1 LEU 46 -5.900 7.518 0.603
379 1HD2 LEU 46 1HD2 LEU 46 -4.748 10.234 -0.199
380 2HD2 LEU 46 2HD2 LEU 46 -4.463 8.701 -1.020
381 3HD2 LEU 46 3HD2 LEU 46 -3.098 9.667 -0.459
382 H ARG 47 H ARG 47 -1.013 8.887 4.140
383 HA ARG 47 HA ARG 47 -0.234 6.553 2.725
384 1HB ARG 47 2HB ARG 47 1.283 8.462 3.243
385 2HB ARG 47 1HB ARG 47 1.258 7.985 4.934
386 1HG ARG 47 2HG ARG 47 3.280 7.216 3.840
387 2HG ARG 47 1HG ARG 47 2.289 5.850 4.356
388 1HD ARG 47 2HD ARG 47 3.212 5.495 2.120
389 2HD ARG 47 1HD ARG 47 1.453 5.583 2.084
390 HE ARG 47 HE ARG 47 2.219 8.130 1.554
391 1HH1 ARG 47 1HH1 ARG 47 3.055 5.037 0.153
392 2HH1 ARG 47 2HH1 ARG 47 3.348 5.683 -1.426
393 1HH2 ARG 47 1HH2 ARG 47 2.592 8.993 -0.512
394 2HH2 ARG 47 2HH2 ARG 47 3.083 7.948 -1.808
395 H ASN 48 H ASN 48 -1.065 7.221 6.072
396 HA ASN 48 HA ASN 48 -0.399 4.764 7.220
397 1HB ASN 48 2HB ASN 48 -1.038 6.664 8.584
398 2HB ASN 48 1HB ASN 48 -2.649 6.678 7.875
399 1HD2 ASN 48 1HD2 ASN 48 -0.494 5.043 10.057
400 2HD2 ASN 48 2HD2 ASN 48 -1.703 4.114 10.877
401 H LYS 49 H LYS 49 -3.283 5.771 5.453
402 HA LYS 49 HA LYS 49 -4.685 3.325 5.896
403 1HB LYS 49 2HB LYS 49 -5.146 5.519 3.869
404 2HB LYS 49 1HB LYS 49 -6.245 4.175 4.158
405 1HG LYS 49 2HG LYS 49 -5.466 6.292 6.154
406 2HG LYS 49 1HG LYS 49 -7.008 6.171 5.305
407 1HD LYS 49 2HD LYS 49 -7.515 4.095 6.407
408 2HD LYS 49 1HD LYS 49 -5.909 4.037 7.132
409 1HE LYS 49 2HE LYS 49 -7.545 4.767 8.765
410 2HE LYS 49 1HE LYS 49 -6.415 6.070 8.404
411 1HZ LYS 49 1HZ LYS 49 -8.068 7.050 6.933
412 2HZ LYS 49 2HZ LYS 49 -8.682 6.874 8.501
413 3HZ LYS 49 3HZ LYS 49 -9.155 5.795 7.283
414 H ILE 50 H ILE 50 -2.532 4.558 3.431
415 HA ILE 50 HA ILE 50 -2.870 2.517 1.528
416 HB ILE 50 HB ILE 50 -0.404 4.147 2.163
417 1HG1 ILE 50 2HG1 ILE 50 -2.499 4.467 0.005
418 2HG1 ILE 50 1HG1 ILE 50 -2.382 5.454 1.458
419 1HG2 ILE 50 1HG2 ILE 50 -1.003 2.420 -0.235
420 2HG2 ILE 50 2HG2 ILE 50 0.235 2.126 0.987
421 3HG2 ILE 50 3HG2 ILE 50 0.370 3.518 -0.087
422 1HD1 ILE 50 1HD1 ILE 50 -0.194 6.264 0.712
423 2HD1 ILE 50 2HD1 ILE 50 -1.463 6.611 -0.461
424 3HD1 ILE 50 3HD1 ILE 50 -0.339 5.284 -0.748
425 H ALA 51 H ALA 51 -0.800 2.770 4.385
426 HA ALA 51 HA ALA 51 0.616 0.370 4.081
427 1HB ALA 51 1HB ALA 51 -0.217 1.725 6.645
428 2HB ALA 51 2HB ALA 51 1.230 2.096 5.708
429 3HB ALA 51 3HB ALA 51 1.059 0.517 6.473
430 H GLY 52 H GLY 52 -2.452 1.063 5.724
431 1HA GLY 52 2HA GLY 52 -3.003 -1.564 6.580
432 2HA GLY 52 1HA GLY 52 -4.204 -0.309 6.302
433 H TYR 53 H TYR 53 -3.491 0.058 3.516
434 HA TYR 53 HA TYR 53 -5.131 -1.963 2.363
435 1HB TYR 53 2HB TYR 53 -4.838 0.487 1.612
436 2HB TYR 53 1HB TYR 53 -3.381 -0.071 0.798
437 HD1 TYR 53 1HD TYR 53 -3.512 -1.251 -1.272
438 HD2 TYR 53 2HD TYR 53 -7.049 -0.433 0.945
439 HE1 TYR 53 1HE TYR 53 -4.876 -1.951 -3.196
440 HE2 TYR 53 2HE TYR 53 -8.421 -1.129 -0.970
441 HH TYR 53 HH TYR 53 -8.200 -1.316 -3.416
442 H ILE 54 H ILE 54 -1.676 -1.426 2.618
443 HA ILE 54 HA ILE 54 -0.764 -3.338 0.786
444 HB ILE 54 HB ILE 54 0.473 -2.527 3.426
445 1HG1 ILE 54 2HG1 ILE 54 1.042 -1.587 0.605
446 2HG1 ILE 54 1HG1 ILE 54 0.147 -0.675 1.818
447 1HG2 ILE 54 1HG2 ILE 54 1.360 -4.669 2.670
448 2HG2 ILE 54 2HG2 ILE 54 2.574 -3.399 2.518
449 3HG2 ILE 54 3HG2 ILE 54 1.718 -3.974 1.088
450 1HD1 ILE 54 1HD1 ILE 54 2.131 -0.554 3.212
451 2HD1 ILE 54 2HD1 ILE 54 2.447 0.104 1.605
452 3HD1 ILE 54 3HD1 ILE 54 3.033 -1.505 2.032
453 H THR 55 H THR 55 -1.466 -3.681 4.272
454 HA THR 55 HA THR 55 -1.047 -6.451 4.390
455 HB THR 55 HB THR 55 -2.850 -6.133 6.350
456 HG1 THR 55 1HG THR 55 -3.333 -3.959 5.718
457 1HG2 THR 55 1HG2 THR 55 -0.967 -5.511 7.809
458 2HG2 THR 55 2HG2 THR 55 -0.015 -5.092 6.386
459 3HG2 THR 55 3HG2 THR 55 -0.513 -6.762 6.653
460 H ARG 56 H ARG 56 -3.829 -4.588 3.344
461 HA ARG 56 HA ARG 56 -5.663 -6.751 3.213
462 1HB ARG 56 2HB ARG 56 -6.670 -4.644 3.146
463 2HB ARG 56 1HB ARG 56 -5.546 -4.034 1.939
464 1HG ARG 56 2HG ARG 56 -6.606 -5.296 0.211
465 2HG ARG 56 1HG ARG 56 -7.602 -6.156 1.384
466 1HD ARG 56 2HD ARG 56 -8.895 -4.255 1.847
467 2HD ARG 56 1HD ARG 56 -7.723 -3.171 1.099
468 HE ARG 56 HE ARG 56 -8.584 -3.685 -0.984
469 1HH1 ARG 56 1HH1 ARG 56 -9.989 -5.830 1.406
470 2HH1 ARG 56 2HH1 ARG 56 -11.341 -6.264 0.403
471 1HH2 ARG 56 1HH2 ARG 56 -10.346 -4.283 -2.312
472 2HH2 ARG 56 2HH2 ARG 56 -11.530 -5.407 -1.720
473 H ILE 57 H ILE 57 -3.390 -5.361 0.885
474 HA ILE 57 HA ILE 57 -4.089 -6.940 -1.325
475 HB ILE 57 HB ILE 57 -1.374 -5.830 -0.586
476 1HG1 ILE 57 2HG1 ILE 57 -3.517 -4.755 -2.434
477 2HG1 ILE 57 1HG1 ILE 57 -3.157 -4.135 -0.827
478 1HG2 ILE 57 1HG2 ILE 57 -1.208 -7.656 -2.216
479 2HG2 ILE 57 2HG2 ILE 57 -0.790 -6.100 -2.934
480 3HG2 ILE 57 3HG2 ILE 57 -2.365 -6.825 -3.256
481 1HD1 ILE 57 1HD1 ILE 57 -1.293 -4.123 -3.186
482 2HD1 ILE 57 2HD1 ILE 57 -0.918 -3.511 -1.575
483 3HD1 ILE 57 3HD1 ILE 57 -2.174 -2.739 -2.541
484 H ILE 58 H ILE 58 -1.749 -7.488 1.271
485 HA ILE 58 HA ILE 58 -0.676 -9.894 0.316
486 HB ILE 58 HB ILE 58 -0.953 -8.941 3.173
487 1HG1 ILE 58 2HG1 ILE 58 1.359 -8.720 1.230
488 2HG1 ILE 58 1HG1 ILE 58 0.257 -7.407 1.631
489 1HG2 ILE 58 1HG2 ILE 58 0.909 -11.018 2.025
490 2HG2 ILE 58 2HG2 ILE 58 -0.514 -11.362 3.007
491 3HG2 ILE 58 3HG2 ILE 58 0.847 -10.481 3.705
492 1HD1 ILE 58 1HD1 ILE 58 2.360 -7.214 2.827
493 2HD1 ILE 58 2HD1 ILE 58 2.106 -8.803 3.548
494 3HD1 ILE 58 3HD1 ILE 58 1.019 -7.472 3.942
495 H SER 59 H SER 59 -3.301 -9.345 2.664
496 HA SER 59 HA SER 59 -3.840 -12.085 3.090
497 1HB SER 59 2HB SER 59 -6.055 -11.161 3.998
498 2HB SER 59 1HB SER 59 -4.570 -10.621 4.781
499 HG SER 59 HG SER 59 -4.847 -8.654 4.003
500 H GLN 60 H GLN 60 -5.111 -9.741 0.786
501 HA GLN 60 HA GLN 60 -7.221 -11.423 -0.148
502 1HB GLN 60 2HB GLN 60 -7.275 -8.969 -0.383
503 2HB GLN 60 1HB GLN 60 -5.911 -9.050 -1.487
504 1HG GLN 60 2HG GLN 60 -7.265 -10.350 -3.055
505 2HG GLN 60 1HG GLN 60 -8.635 -10.247 -1.953
506 1HE2 GLN 60 1HE2 GLN 60 -6.395 -7.619 -2.454
507 2HE2 GLN 60 2HE2 GLN 60 -7.493 -6.586 -3.294
508 H GLN 61 H GLN 61 -3.888 -10.863 -1.100
509 HA GLN 61 HA GLN 61 -4.064 -12.302 -3.561
510 1HB GLN 61 2HB GLN 61 -2.337 -10.516 -2.846
511 2HB GLN 61 1HB GLN 61 -1.522 -11.829 -2.014
512 1HG GLN 61 2HG GLN 61 -2.173 -11.932 -4.941
513 2HG GLN 61 1HG GLN 61 -0.686 -11.223 -4.323
514 1HE2 GLN 61 1HE2 GLN 61 -1.074 -13.515 -6.067
515 2HE2 GLN 61 2HE2 GLN 61 -0.326 -14.862 -5.277
516 H LYS 62 H LYS 62 -2.695 -13.073 -0.367
517 HA LYS 62 HA LYS 62 -2.716 -15.918 -1.144
518 1HB LYS 62 2HB LYS 62 -0.465 -15.002 -0.712
519 2HB LYS 62 1HB LYS 62 -0.977 -14.521 0.900
520 1HG LYS 62 2HG LYS 62 -1.546 -17.046 1.176
521 2HG LYS 62 1HG LYS 62 -0.434 -17.248 -0.178
522 1HD LYS 62 2HD LYS 62 0.950 -17.479 1.673
523 2HD LYS 62 1HD LYS 62 1.171 -15.786 1.227
524 1HE LYS 62 2HE LYS 62 -0.632 -16.842 3.409
525 2HE LYS 62 1HE LYS 62 0.911 -16.027 3.642
526 1HZ LYS 62 1HZ LYS 62 -0.879 -14.491 4.013
527 2HZ LYS 62 2HZ LYS 62 -1.566 -14.837 2.501
528 3HZ LYS 62 3HZ LYS 62 -0.071 -14.044 2.593
Start of MODEL 11
1 1H MET 1 1HT MET 1 -11.957 -2.714 -14.743
2 2H MET 1 2HT MET 1 -11.610 -2.851 -13.090
3 3H MET 1 3HT MET 1 -11.931 -1.331 -13.761
4 HA MET 1 HA MET 1 -14.179 -1.956 -14.250
5 1HB MET 1 2HB MET 1 -15.116 -4.053 -13.519
6 2HB MET 1 1HB MET 1 -13.737 -4.377 -14.557
7 1HG MET 1 2HG MET 1 -13.659 -4.458 -11.548
8 2HG MET 1 1HG MET 1 -13.898 -5.865 -12.586
9 1HE MET 1 1HE MET 1 -11.873 -7.080 -11.411
10 2HE MET 1 2HE MET 1 -11.587 -5.685 -10.374
11 3HE MET 1 3HE MET 1 -10.251 -6.399 -11.277
12 H GLY 2 H GLY 2 -12.111 -2.304 -11.463
13 1HA GLY 2 2HA GLY 2 -14.282 -1.248 -9.765
14 2HA GLY 2 1HA GLY 2 -12.863 -2.104 -9.173
15 H ASN 3 H ASN 3 -14.184 0.757 -9.058
16 HA ASN 3 HA ASN 3 -13.411 2.782 -8.389
17 1HB ASN 3 2HB ASN 3 -11.456 2.745 -7.306
18 2HB ASN 3 1HB ASN 3 -11.109 1.178 -8.027
19 1HD2 ASN 3 1HD2 ASN 3 -9.761 1.068 -9.823
20 2HD2 ASN 3 2HD2 ASN 3 -8.749 2.389 -10.297
21 H ILE 4 H ILE 4 -13.034 4.735 -9.359
22 HA ILE 4 HA ILE 4 -12.535 4.642 -12.251
23 HB ILE 4 HB ILE 4 -13.784 6.872 -10.627
24 1HG1 ILE 4 2HG1 ILE 4 -15.086 4.862 -12.477
25 2HG1 ILE 4 1HG1 ILE 4 -15.190 4.831 -10.722
26 1HG2 ILE 4 1HG2 ILE 4 -14.421 7.796 -12.813
27 2HG2 ILE 4 2HG2 ILE 4 -13.531 6.501 -13.612
28 3HG2 ILE 4 3HG2 ILE 4 -12.671 7.687 -12.631
29 1HD1 ILE 4 1HD1 ILE 4 -16.280 6.967 -12.541
30 2HD1 ILE 4 2HD1 ILE 4 -16.337 7.002 -10.778
31 3HD1 ILE 4 3HD1 ILE 4 -17.208 5.750 -11.663
32 H ARG 5 H ARG 5 -12.064 7.157 -9.762
33 HA ARG 5 HA ARG 5 -9.299 7.372 -10.713
34 1HB ARG 5 2HB ARG 5 -11.289 9.520 -10.151
35 2HB ARG 5 1HB ARG 5 -9.583 9.843 -9.864
36 1HG ARG 5 2HG ARG 5 -9.072 9.281 -12.176
37 2HG ARG 5 1HG ARG 5 -10.772 8.912 -12.471
38 1HD ARG 5 2HD ARG 5 -10.090 11.161 -13.259
39 2HD ARG 5 1HD ARG 5 -11.398 11.188 -12.080
40 HE ARG 5 HE ARG 5 -8.614 11.669 -11.235
41 1HH1 ARG 5 1HH1 ARG 5 -11.961 12.670 -11.507
42 2HH1 ARG 5 2HH1 ARG 5 -11.745 14.128 -10.582
43 1HH2 ARG 5 1HH2 ARG 5 -8.316 13.582 -9.981
44 2HH2 ARG 5 2HH2 ARG 5 -9.674 14.632 -9.689
45 H THR 6 H THR 6 -8.856 5.843 -9.114
46 HA THR 6 HA THR 6 -7.803 7.082 -6.736
47 HB THR 6 HB THR 6 -9.647 4.695 -6.370
48 HG1 THR 6 1HG THR 6 -10.272 7.363 -6.545
49 1HG2 THR 6 1HG2 THR 6 -7.878 4.946 -4.688
50 2HG2 THR 6 2HG2 THR 6 -9.471 5.237 -3.992
51 3HG2 THR 6 3HG2 THR 6 -8.414 6.596 -4.370
52 H SER 7 H SER 7 -7.612 5.223 -9.324
53 HA SER 7 HA SER 7 -6.345 2.845 -8.497
54 1HB SER 7 2HB SER 7 -5.514 3.059 -11.010
55 2HB SER 7 1HB SER 7 -7.199 2.687 -10.635
56 HG SER 7 HG SER 7 -6.726 4.479 -12.191
57 H PHE 8 H PHE 8 -5.276 6.086 -8.761
58 HA PHE 8 HA PHE 8 -2.559 5.799 -9.254
59 1HB PHE 8 2HB PHE 8 -3.737 7.974 -9.080
60 2HB PHE 8 1HB PHE 8 -3.878 7.742 -7.342
61 HD1 PHE 8 1HD PHE 8 -2.188 8.472 -5.919
62 HD2 PHE 8 2HD PHE 8 -1.385 8.051 -10.075
63 HE1 PHE 8 1HE PHE 8 0.002 9.552 -5.602
64 HE2 PHE 8 2HE PHE 8 0.803 9.131 -9.767
65 HZ PHE 8 HZ PHE 8 1.501 9.881 -7.531
66 H VAL 9 H VAL 9 -4.383 5.429 -6.255
67 HA VAL 9 HA VAL 9 -2.140 4.968 -4.574
68 HB VAL 9 HB VAL 9 -4.973 3.989 -4.169
69 1HG1 VAL 9 1HG1 VAL 9 -4.414 4.076 -1.780
70 2HG1 VAL 9 2HG1 VAL 9 -2.757 4.518 -2.194
71 3HG1 VAL 9 3HG1 VAL 9 -3.391 2.939 -2.657
72 1HG2 VAL 9 1HG2 VAL 9 -5.323 6.057 -2.889
73 2HG2 VAL 9 2HG2 VAL 9 -4.981 6.376 -4.591
74 3HG2 VAL 9 3HG2 VAL 9 -3.722 6.615 -3.378
75 H LYS 10 H LYS 10 -4.181 2.915 -6.557
76 HA LYS 10 HA LYS 10 -3.189 0.420 -5.647
77 1HB LYS 10 2HB LYS 10 -4.425 1.164 -8.306
78 2HB LYS 10 1HB LYS 10 -4.171 -0.479 -7.733
79 1HG LYS 10 2HG LYS 10 -5.916 1.549 -6.346
80 2HG LYS 10 1HG LYS 10 -6.501 0.336 -7.483
81 1HD LYS 10 2HD LYS 10 -5.005 -0.305 -4.943
82 2HD LYS 10 1HD LYS 10 -6.763 -0.293 -5.080
83 1HE LYS 10 2HE LYS 10 -4.930 -2.011 -6.751
84 2HE LYS 10 1HE LYS 10 -5.744 -2.555 -5.284
85 1HZ LYS 10 1HZ LYS 10 -7.091 -1.605 -7.765
86 2HZ LYS 10 2HZ LYS 10 -7.876 -2.117 -6.350
87 3HZ LYS 10 3HZ LYS 10 -6.961 -3.217 -7.255
88 H ARG 11 H ARG 11 -2.128 2.746 -8.034
89 HA ARG 11 HA ARG 11 -0.123 1.052 -9.192
90 1HB ARG 11 2HB ARG 11 -0.259 4.073 -9.261
91 2HB ARG 11 1HB ARG 11 0.666 3.035 -10.336
92 1HG ARG 11 2HG ARG 11 -2.330 3.282 -10.182
93 2HG ARG 11 1HG ARG 11 -1.278 3.824 -11.487
94 1HD ARG 11 2HD ARG 11 -0.656 1.502 -11.950
95 2HD ARG 11 1HD ARG 11 -1.706 0.961 -10.639
96 HE ARG 11 HE ARG 11 -2.882 2.500 -12.839
97 1HH1 ARG 11 1HH1 ARG 11 -2.556 -0.558 -11.148
98 2HH1 ARG 11 2HH1 ARG 11 -3.887 -1.290 -11.980
99 1HH2 ARG 11 1HH2 ARG 11 -4.632 1.548 -13.905
100 2HH2 ARG 11 2HH2 ARG 11 -5.084 -0.099 -13.541
101 H ILE 12 H ILE 12 -0.276 3.369 -6.567
102 HA ILE 12 HA ILE 12 2.462 3.576 -5.997
103 HB ILE 12 HB ILE 12 0.090 3.705 -4.126
104 1HG1 ILE 12 2HG1 ILE 12 1.762 5.904 -5.371
105 2HG1 ILE 12 1HG1 ILE 12 0.155 5.426 -5.909
106 1HG2 ILE 12 1HG2 ILE 12 1.591 4.819 -2.543
107 2HG2 ILE 12 2HG2 ILE 12 2.952 4.509 -3.620
108 3HG2 ILE 12 3HG2 ILE 12 2.095 3.162 -2.870
109 1HD1 ILE 12 1HD1 ILE 12 0.086 7.435 -4.542
110 2HD1 ILE 12 2HD1 ILE 12 0.836 6.561 -3.206
111 3HD1 ILE 12 3HD1 ILE 12 -0.772 6.105 -3.766
112 H ALA 13 H ALA 13 0.008 1.428 -4.548
113 HA ALA 13 HA ALA 13 1.746 -0.134 -3.016
114 1HB ALA 13 1HB ALA 13 -0.703 -0.169 -2.776
115 2HB ALA 13 2HB ALA 13 -0.034 -1.790 -2.959
116 3HB ALA 13 3HB ALA 13 -0.833 -1.008 -4.322
117 H LYS 14 H LYS 14 0.689 -0.462 -6.358
118 HA LYS 14 HA LYS 14 1.869 -2.849 -7.080
119 1HB LYS 14 2HB LYS 14 0.550 -1.904 -8.729
120 2HB LYS 14 1HB LYS 14 1.240 -0.305 -8.515
121 1HG LYS 14 2HG LYS 14 1.900 -1.112 -10.645
122 2HG LYS 14 1HG LYS 14 3.321 -1.129 -9.604
123 1HD LYS 14 2HD LYS 14 3.001 -3.545 -9.248
124 2HD LYS 14 1HD LYS 14 1.613 -3.506 -10.341
125 1HE LYS 14 2HE LYS 14 3.093 -2.660 -12.130
126 2HE LYS 14 1HE LYS 14 4.465 -2.814 -11.034
127 1HZ LYS 14 1HZ LYS 14 2.753 -5.026 -12.027
128 2HZ LYS 14 2HZ LYS 14 4.017 -5.206 -10.909
129 3HZ LYS 14 3HZ LYS 14 4.350 -4.700 -12.490
130 H GLU 15 H GLU 15 3.352 0.398 -7.266
131 HA GLU 15 HA GLU 15 5.860 -0.642 -8.118
132 1HB GLU 15 2HB GLU 15 5.053 1.637 -8.668
133 2HB GLU 15 1HB GLU 15 5.253 2.089 -6.981
134 1HG GLU 15 2HG GLU 15 7.599 1.869 -7.098
135 2HG GLU 15 1HG GLU 15 7.513 1.050 -8.657
136 H MET 16 H MET 16 4.476 0.052 -4.992
137 HA MET 16 HA MET 16 6.895 0.116 -3.528
138 1HB MET 16 2HB MET 16 4.072 -0.548 -2.700
139 2HB MET 16 1HB MET 16 5.413 -0.486 -1.564
140 1HG MET 16 2HG MET 16 5.794 1.849 -2.114
141 2HG MET 16 1HG MET 16 4.478 1.797 -3.282
142 1HE MET 16 1HE MET 16 5.418 1.530 0.541
143 2HE MET 16 2HE MET 16 4.577 0.017 0.215
144 3HE MET 16 3HE MET 16 3.836 1.236 1.256
145 H ILE 17 H ILE 17 4.655 -2.508 -4.302
146 HA ILE 17 HA ILE 17 6.256 -4.517 -3.012
147 HB ILE 17 HB ILE 17 3.994 -4.830 -4.996
148 1HG1 ILE 17 2HG1 ILE 17 3.960 -4.998 -1.974
149 2HG1 ILE 17 1HG1 ILE 17 3.379 -3.623 -2.906
150 1HG2 ILE 17 1HG2 ILE 17 3.815 -7.113 -4.082
151 2HG2 ILE 17 2HG2 ILE 17 5.272 -6.830 -3.131
152 3HG2 ILE 17 3HG2 ILE 17 5.355 -6.832 -4.893
153 1HD1 ILE 17 1HD1 ILE 17 2.255 -6.412 -2.980
154 2HD1 ILE 17 2HD1 ILE 17 1.676 -5.044 -3.930
155 3HD1 ILE 17 3HD1 ILE 17 1.542 -5.014 -2.173
156 H GLU 18 H GLU 18 6.005 -3.140 -6.199
157 HA GLU 18 HA GLU 18 7.126 -5.218 -7.717
158 1HB GLU 18 2HB GLU 18 5.945 -2.884 -8.320
159 2HB GLU 18 1HB GLU 18 7.619 -2.402 -8.537
160 1HG GLU 18 2HG GLU 18 6.376 -4.775 -9.900
161 2HG GLU 18 1HG GLU 18 6.441 -3.159 -10.599
162 H THR 19 H THR 19 9.046 -6.077 -7.436
163 HA THR 19 HA THR 19 11.303 -6.296 -7.480
164 HB THR 19 HB THR 19 11.376 -3.278 -7.614
165 HG1 THR 19 1HG THR 19 10.481 -4.722 -9.416
166 1HG2 THR 19 1HG2 THR 19 13.470 -4.143 -6.711
167 2HG2 THR 19 2HG2 THR 19 13.705 -3.571 -8.362
168 3HG2 THR 19 3HG2 THR 19 13.581 -5.301 -8.037
169 H HIS 20 H HIS 20 10.062 -3.800 -5.296
170 HA HIS 20 HA HIS 20 12.023 -4.522 -3.257
171 1HB HIS 20 2HB HIS 20 11.663 -2.195 -3.342
172 2HB HIS 20 1HB HIS 20 9.923 -2.378 -3.504
173 HD1 HIS 20 1HD HIS 20 8.554 -2.361 -1.413
174 HD2 HIS 20 2HD HIS 20 12.634 -2.618 -0.638
175 HE1 HIS 20 1HE HIS 20 8.794 -2.033 1.074
176 HE2 HIS 20 2HE HIS 20 11.277 -2.083 1.514
177 HA PRO 21 HA PRO 21 8.762 -7.314 -1.877
178 1HB PRO 21 2HB PRO 21 10.487 -9.367 -1.290
179 2HB PRO 21 1HB PRO 21 9.822 -9.055 -2.894
180 1HG PRO 21 2HG PRO 21 12.549 -8.805 -2.019
181 2HG PRO 21 1HG PRO 21 11.890 -8.542 -3.641
182 1HD PRO 21 2HD PRO 21 12.545 -6.578 -1.534
183 2HD PRO 21 1HD PRO 21 12.414 -6.350 -3.291
184 H GLY 22 H GLY 22 8.158 -6.325 0.028
185 1HA GLY 22 2HA GLY 22 9.817 -6.724 2.400
186 2HA GLY 22 1HA GLY 22 8.296 -5.838 2.331
187 H LYS 23 H LYS 23 6.874 -6.808 3.611
188 HA LYS 23 HA LYS 23 5.397 -8.343 4.375
189 1HB LYS 23 2HB LYS 23 4.971 -8.672 1.962
190 2HB LYS 23 1HB LYS 23 6.206 -9.919 1.923
191 1HG LYS 23 2HG LYS 23 4.817 -11.114 3.692
192 2HG LYS 23 1HG LYS 23 3.529 -9.981 3.274
193 1HD LYS 23 2HD LYS 23 4.936 -11.846 1.362
194 2HD LYS 23 1HD LYS 23 3.325 -12.088 2.036
195 1HE LYS 23 2HE LYS 23 2.506 -10.117 0.909
196 2HE LYS 23 1HE LYS 23 4.129 -9.729 0.336
197 1HZ LYS 23 1HZ LYS 23 4.129 -11.672 -1.033
198 2HZ LYS 23 2HZ LYS 23 2.700 -10.818 -1.352
199 3HZ LYS 23 3HZ LYS 23 2.658 -12.209 -0.378
200 H PHE 24 H PHE 24 7.002 -8.617 6.132
201 HA PHE 24 HA PHE 24 8.381 -11.171 6.155
202 1HB PHE 24 2HB PHE 24 9.260 -9.091 7.313
203 2HB PHE 24 1HB PHE 24 7.940 -9.262 8.466
204 HD1 PHE 24 1HD PHE 24 7.907 -11.123 10.053
205 HD2 PHE 24 2HD PHE 24 11.160 -10.548 7.371
206 HE1 PHE 24 1HE PHE 24 9.285 -12.654 11.400
207 HE2 PHE 24 2HE PHE 24 12.543 -12.076 8.715
208 HZ PHE 24 HZ PHE 24 11.603 -13.133 10.731
209 H THR 25 H THR 25 5.546 -9.632 7.500
210 HA THR 25 HA THR 25 4.214 -12.177 7.750
211 HB THR 25 HB THR 25 4.393 -10.380 10.192
212 HG1 THR 25 1HG THR 25 6.127 -12.271 9.263
213 1HG2 THR 25 1HG2 THR 25 2.356 -11.695 10.128
214 2HG2 THR 25 2HG2 THR 25 3.437 -12.365 11.348
215 3HG2 THR 25 3HG2 THR 25 3.274 -13.160 9.783
216 H ASP 26 H ASP 26 1.814 -11.691 8.380
217 HA ASP 26 HA ASP 26 0.960 -9.461 6.754
218 1HB ASP 26 2HB ASP 26 -1.301 -10.365 7.088
219 2HB ASP 26 1HB ASP 26 -0.181 -11.614 6.559
220 H ASP 27 H ASP 27 2.305 -8.898 9.292
221 HA ASP 27 HA ASP 27 0.200 -7.826 10.998
222 1HB ASP 27 2HB ASP 27 2.137 -9.023 12.015
223 2HB ASP 27 1HB ASP 27 3.201 -7.765 11.401
224 H PHE 28 H PHE 28 0.465 -5.583 11.827
225 HA PHE 28 HA PHE 28 0.447 -3.809 9.614
226 1HB PHE 28 2HB PHE 28 0.248 -3.301 12.584
227 2HB PHE 28 1HB PHE 28 0.035 -2.058 11.357
228 HD1 PHE 28 1HD PHE 28 -1.906 -2.088 9.882
229 HD2 PHE 28 2HD PHE 28 -1.441 -4.957 12.990
230 HE1 PHE 28 1HE PHE 28 -4.284 -2.691 9.680
231 HE2 PHE 28 2HE PHE 28 -3.816 -5.565 12.793
232 HZ PHE 28 HZ PHE 28 -5.241 -4.432 11.136
233 H ASP 29 H ASP 29 2.845 -4.595 12.066
234 HA ASP 29 HA ASP 29 4.465 -2.292 11.734
235 1HB ASP 29 2HB ASP 29 4.708 -3.874 13.629
236 2HB ASP 29 1HB ASP 29 5.346 -5.081 12.520
237 H THR 30 H THR 30 4.164 -5.260 9.943
238 HA THR 30 HA THR 30 6.472 -5.014 8.341
239 HB THR 30 HB THR 30 3.822 -6.342 7.731
240 HG1 THR 30 1HG THR 30 5.799 -6.969 9.414
241 1HG2 THR 30 1HG2 THR 30 5.091 -5.906 5.683
242 2HG2 THR 30 2HG2 THR 30 5.064 -7.630 6.057
243 3HG2 THR 30 3HG2 THR 30 6.508 -6.676 6.394
244 H ASN 31 H ASN 31 3.071 -4.112 7.703
245 HA ASN 31 HA ASN 31 3.518 -2.825 5.251
246 1HB ASN 31 2HB ASN 31 1.309 -3.539 6.396
247 2HB ASN 31 1HB ASN 31 1.393 -1.983 7.212
248 1HD2 ASN 31 1HD2 ASN 31 2.577 -0.629 4.893
249 2HD2 ASN 31 2HD2 ASN 31 1.281 -0.450 3.761
250 H LYS 32 H LYS 32 3.587 -1.689 8.563
251 HA LYS 32 HA LYS 32 3.868 1.022 8.306
252 1HB LYS 32 2HB LYS 32 3.734 0.311 10.481
253 2HB LYS 32 1HB LYS 32 4.841 -1.028 10.232
254 1HG LYS 32 2HG LYS 32 6.704 0.633 10.163
255 2HG LYS 32 1HG LYS 32 5.532 1.874 10.624
256 1HD LYS 32 2HD LYS 32 5.123 0.878 12.706
257 2HD LYS 32 1HD LYS 32 5.844 -0.654 12.213
258 1HE LYS 32 2HE LYS 32 8.051 0.499 12.100
259 2HE LYS 32 1HE LYS 32 7.276 1.943 12.757
260 1HZ LYS 32 1HZ LYS 32 6.745 0.774 14.753
261 2HZ LYS 32 2HZ LYS 32 8.397 0.548 14.450
262 3HZ LYS 32 3HZ LYS 32 7.295 -0.702 14.116
263 H LYS 33 H LYS 33 6.491 -1.396 8.108
264 HA LYS 33 HA LYS 33 8.501 0.578 7.691
265 1HB LYS 33 2HB LYS 33 8.991 -1.671 8.613
266 2HB LYS 33 1HB LYS 33 8.609 -2.373 7.045
267 1HG LYS 33 2HG LYS 33 10.433 -1.071 6.038
268 2HG LYS 33 1HG LYS 33 10.834 -0.432 7.631
269 1HD LYS 33 2HD LYS 33 11.319 -2.692 8.419
270 2HD LYS 33 1HD LYS 33 10.892 -3.343 6.833
271 1HE LYS 33 2HE LYS 33 12.681 -1.935 5.840
272 2HE LYS 33 1HE LYS 33 13.156 -1.454 7.468
273 1HZ LYS 33 1HZ LYS 33 14.503 -3.272 6.535
274 2HZ LYS 33 2HZ LYS 33 13.125 -4.262 6.492
275 3HZ LYS 33 3HZ LYS 33 13.725 -3.705 7.981
276 H LEU 34 H LEU 34 6.575 -1.456 5.550
277 HA LEU 34 HA LEU 34 7.971 -0.998 3.170
278 1HB LEU 34 2HB LEU 34 5.237 -1.883 3.878
279 2HB LEU 34 1HB LEU 34 5.459 -1.280 2.246
280 HG LEU 34 HG LEU 34 7.180 -2.962 1.829
281 1HD1 LEU 34 1HD1 LEU 34 6.603 -3.926 4.625
282 2HD1 LEU 34 2HD1 LEU 34 8.087 -3.139 4.087
283 3HD1 LEU 34 3HD1 LEU 34 7.644 -4.722 3.445
284 1HD2 LEU 34 1HD2 LEU 34 5.752 -4.935 1.864
285 2HD2 LEU 34 2HD2 LEU 34 4.847 -3.506 1.361
286 3HD2 LEU 34 3HD2 LEU 34 4.661 -4.136 2.998
287 H VAL 35 H VAL 35 5.411 0.893 4.716
288 HA VAL 35 HA VAL 35 5.226 2.775 2.559
289 HB VAL 35 HB VAL 35 4.288 3.076 5.421
290 1HG1 VAL 35 1HG1 VAL 35 2.756 4.765 4.480
291 2HG1 VAL 35 2HG1 VAL 35 3.557 4.593 2.918
292 3HG1 VAL 35 3HG1 VAL 35 4.449 5.217 4.305
293 1HG2 VAL 35 1HG2 VAL 35 2.797 2.137 2.973
294 2HG2 VAL 35 2HG2 VAL 35 2.088 2.425 4.564
295 3HG2 VAL 35 3HG2 VAL 35 3.274 1.138 4.345
296 H GLU 36 H GLU 36 6.943 2.584 5.617
297 HA GLU 36 HA GLU 36 7.930 5.213 5.708
298 1HB GLU 36 2HB GLU 36 7.953 3.378 7.518
299 2HB GLU 36 1HB GLU 36 9.412 2.795 6.739
300 1HG GLU 36 2HG GLU 36 9.117 5.602 7.766
301 2HG GLU 36 1HG GLU 36 9.725 4.275 8.749
302 H GLU 37 H GLU 37 9.340 2.224 4.400
303 HA GLU 37 HA GLU 37 11.760 3.351 3.523
304 1HB GLU 37 2HB GLU 37 10.275 0.928 2.508
305 2HB GLU 37 1HB GLU 37 11.923 1.340 2.062
306 1HG GLU 37 2HG GLU 37 12.523 1.187 4.481
307 2HG GLU 37 1HG GLU 37 10.899 0.565 4.775
308 H PHE 38 H PHE 38 8.959 2.384 1.511
309 HA PHE 38 HA PHE 38 10.205 3.900 -0.665
310 1HB PHE 38 2HB PHE 38 9.750 1.399 -0.865
311 2HB PHE 38 1HB PHE 38 8.044 1.814 -0.952
312 HD1 PHE 38 1HD PHE 38 11.277 2.007 -2.652
313 HD2 PHE 38 2HD PHE 38 7.103 2.794 -2.937
314 HE1 PHE 38 1HE PHE 38 11.505 2.329 -5.079
315 HE2 PHE 38 2HE PHE 38 7.324 3.116 -5.365
316 HZ PHE 38 HZ PHE 38 9.527 2.882 -6.440
317 H SER 39 H SER 39 6.830 2.926 -0.352
318 HA SER 39 HA SER 39 4.899 3.974 -0.845
319 1HB SER 39 2HB SER 39 4.383 5.965 0.460
320 2HB SER 39 1HB SER 39 5.273 4.809 1.447
321 HG SER 39 HG SER 39 7.152 6.220 0.507
322 H THR 40 H THR 40 4.022 6.388 -1.433
323 HA THR 40 HA THR 40 5.806 7.746 -3.283
324 HB THR 40 HB THR 40 3.059 6.788 -4.130
325 HG1 THR 40 1HG THR 40 5.532 5.650 -4.275
326 1HG2 THR 40 1HG2 THR 40 3.691 8.968 -5.078
327 2HG2 THR 40 2HG2 THR 40 3.659 7.711 -6.315
328 3HG2 THR 40 3HG2 THR 40 5.200 8.270 -5.663
329 H VAL 41 H VAL 41 5.742 9.786 -2.637
330 HA VAL 41 HA VAL 41 5.111 11.702 -1.596
331 HB VAL 41 HB VAL 41 2.251 10.848 -2.122
332 1HG1 VAL 41 1HG1 VAL 41 1.736 13.228 -1.914
333 2HG1 VAL 41 2HG1 VAL 41 3.427 13.569 -1.547
334 3HG1 VAL 41 3HG1 VAL 41 2.461 12.605 -0.430
335 1HG2 VAL 41 1HG2 VAL 41 3.509 10.943 -4.202
336 2HG2 VAL 41 2HG2 VAL 41 4.098 12.553 -3.791
337 3HG2 VAL 41 3HG2 VAL 41 2.381 12.296 -4.105
338 H SER 42 H SER 42 5.985 10.895 0.316
339 HA SER 42 HA SER 42 4.505 9.194 2.061
340 1HB SER 42 2HB SER 42 7.014 10.800 2.593
341 2HB SER 42 1HB SER 42 6.392 9.494 3.602
342 HG SER 42 HG SER 42 6.538 8.247 1.479
343 H THR 43 H THR 43 2.591 10.214 2.537
344 HA THR 43 HA THR 43 2.663 12.734 3.991
345 HB THR 43 HB THR 43 0.102 12.242 4.070
346 HG1 THR 43 1HG THR 43 0.568 10.749 1.746
347 1HG2 THR 43 1HG2 THR 43 1.126 13.993 2.692
348 2HG2 THR 43 2HG2 THR 43 -0.173 13.182 1.813
349 3HG2 THR 43 3HG2 THR 43 1.511 12.797 1.455
350 H LYS 44 H LYS 44 0.731 12.510 5.872
351 HA LYS 44 HA LYS 44 2.044 10.649 7.717
352 1HB LYS 44 2HB LYS 44 2.062 13.097 8.235
353 2HB LYS 44 1HB LYS 44 0.312 13.023 8.402
354 1HG LYS 44 2HG LYS 44 0.501 11.516 10.263
355 2HG LYS 44 1HG LYS 44 2.248 11.402 10.040
356 1HD LYS 44 2HD LYS 44 2.378 13.863 10.453
357 2HD LYS 44 1HD LYS 44 0.664 13.825 10.875
358 1HE LYS 44 2HE LYS 44 1.113 12.256 12.667
359 2HE LYS 44 1HE LYS 44 2.818 12.204 12.223
360 1HZ LYS 44 1HZ LYS 44 2.924 14.605 12.718
361 2HZ LYS 44 2HZ LYS 44 2.539 13.662 14.070
362 3HZ LYS 44 3HZ LYS 44 1.326 14.539 13.280
363 H HIS 45 H HIS 45 -1.246 11.955 7.161
364 HA HIS 45 HA HIS 45 -2.380 9.844 8.764
365 1HB HIS 45 2HB HIS 45 -3.219 12.358 8.176
366 2HB HIS 45 1HB HIS 45 -4.188 11.424 7.040
367 HD1 HIS 45 1HD HIS 45 -4.956 12.966 9.876
368 HD2 HIS 45 2HD HIS 45 -4.914 8.890 9.028
369 HE1 HIS 45 1HE HIS 45 -6.495 11.905 11.558
370 HE2 HIS 45 2HE HIS 45 -6.283 9.423 11.167
371 H LEU 46 H LEU 46 -1.907 10.486 5.364
372 HA LEU 46 HA LEU 46 -3.672 8.440 4.432
373 1HB LEU 46 2HB LEU 46 -1.441 9.951 3.085
374 2HB LEU 46 1HB LEU 46 -2.384 8.725 2.266
375 HG LEU 46 HG LEU 46 -4.436 10.117 2.778
376 1HD1 LEU 46 1HD1 LEU 46 -4.069 12.503 3.210
377 2HD1 LEU 46 2HD1 LEU 46 -2.350 12.187 3.454
378 3HD1 LEU 46 3HD1 LEU 46 -3.539 11.500 4.561
379 1HD2 LEU 46 1HD2 LEU 46 -3.411 10.033 0.571
380 2HD2 LEU 46 2HD2 LEU 46 -2.293 11.318 1.031
381 3HD2 LEU 46 3HD2 LEU 46 -4.022 11.651 0.922
382 H ARG 47 H ARG 47 -0.507 8.496 5.693
383 HA ARG 47 HA ARG 47 0.654 6.207 4.599
384 1HB ARG 47 2HB ARG 47 1.894 7.706 6.039
385 2HB ARG 47 1HB ARG 47 0.817 7.370 7.384
386 1HG ARG 47 2HG ARG 47 1.617 4.967 7.235
387 2HG ARG 47 1HG ARG 47 2.879 5.572 6.157
388 1HD ARG 47 2HD ARG 47 3.690 5.452 8.449
389 2HD ARG 47 1HD ARG 47 3.617 7.126 7.898
390 HE ARG 47 HE ARG 47 1.404 6.014 9.480
391 1HH1 ARG 47 1HH1 ARG 47 3.999 8.335 9.099
392 2HH1 ARG 47 2HH1 ARG 47 3.556 9.257 10.505
393 1HH2 ARG 47 1HH2 ARG 47 0.797 7.222 11.311
394 2HH2 ARG 47 2HH2 ARG 47 1.718 8.623 11.765
395 H ASN 48 H ASN 48 -1.573 6.601 7.299
396 HA ASN 48 HA ASN 48 -1.626 3.842 8.012
397 1HB ASN 48 2HB ASN 48 -3.475 6.131 8.719
398 2HB ASN 48 1HB ASN 48 -3.585 4.520 9.419
399 1HD2 ASN 48 1HD2 ASN 48 -3.214 5.348 11.482
400 2HD2 ASN 48 2HD2 ASN 48 -1.638 5.858 11.997
401 H LYS 49 H LYS 49 -3.316 5.808 5.726
402 HA LYS 49 HA LYS 49 -5.488 4.024 5.250
403 1HB LYS 49 2HB LYS 49 -4.235 6.143 3.494
404 2HB LYS 49 1HB LYS 49 -5.685 5.246 3.073
405 1HG LYS 49 2HG LYS 49 -6.865 6.183 4.958
406 2HG LYS 49 1HG LYS 49 -5.403 7.021 5.488
407 1HD LYS 49 2HD LYS 49 -5.391 8.357 3.477
408 2HD LYS 49 1HD LYS 49 -6.757 7.451 2.825
409 1HE LYS 49 2HE LYS 49 -6.831 9.106 5.343
410 2HE LYS 49 1HE LYS 49 -7.384 9.655 3.759
411 1HZ LYS 49 1HZ LYS 49 -8.493 7.377 5.318
412 2HZ LYS 49 2HZ LYS 49 -8.984 7.816 3.758
413 3HZ LYS 49 3HZ LYS 49 -9.239 8.880 5.054
414 H ILE 50 H ILE 50 -2.355 4.568 3.678
415 HA ILE 50 HA ILE 50 -2.566 2.508 1.767
416 HB ILE 50 HB ILE 50 -0.054 3.593 3.064
417 1HG1 ILE 50 2HG1 ILE 50 -1.465 4.484 0.539
418 2HG1 ILE 50 1HG1 ILE 50 -1.462 5.362 2.064
419 1HG2 ILE 50 1HG2 ILE 50 -0.423 2.210 0.411
420 2HG2 ILE 50 2HG2 ILE 50 0.293 1.490 1.855
421 3HG2 ILE 50 3HG2 ILE 50 1.089 2.847 1.057
422 1HD1 ILE 50 1HD1 ILE 50 0.970 4.755 0.394
423 2HD1 ILE 50 2HD1 ILE 50 0.935 5.697 1.886
424 3HD1 ILE 50 3HD1 ILE 50 0.114 6.298 0.444
425 H ALA 51 H ALA 51 -1.551 2.569 5.124
426 HA ALA 51 HA ALA 51 -0.497 -0.033 5.293
427 1HB ALA 51 1HB ALA 51 -0.165 1.666 7.035
428 2HB ALA 51 2HB ALA 51 -0.801 0.159 7.693
429 3HB ALA 51 3HB ALA 51 -1.869 1.545 7.470
430 H GLY 52 H GLY 52 -3.796 1.180 5.571
431 1HA GLY 52 2HA GLY 52 -4.965 -1.291 6.331
432 2HA GLY 52 1HA GLY 52 -5.806 0.064 5.589
433 H TYR 53 H TYR 53 -4.379 0.229 3.203
434 HA TYR 53 HA TYR 53 -5.687 -1.668 1.607
435 1HB TYR 53 2HB TYR 53 -3.634 0.432 1.155
436 2HB TYR 53 1HB TYR 53 -3.797 -0.807 -0.084
437 HD1 TYR 53 1HD TYR 53 -5.428 2.031 1.571
438 HD2 TYR 53 2HD TYR 53 -5.794 -0.962 -1.426
439 HE1 TYR 53 1HE TYR 53 -7.343 3.238 0.606
440 HE2 TYR 53 2HE TYR 53 -7.704 0.234 -2.403
441 HH TYR 53 HH TYR 53 -8.548 3.426 -1.463
442 H ILE 54 H ILE 54 -2.180 -1.356 2.241
443 HA ILE 54 HA ILE 54 -1.514 -3.621 0.727
444 HB ILE 54 HB ILE 54 0.096 -2.327 2.927
445 1HG1 ILE 54 2HG1 ILE 54 0.128 -1.973 -0.079
446 2HG1 ILE 54 1HG1 ILE 54 -0.491 -0.810 1.087
447 1HG2 ILE 54 1HG2 ILE 54 0.968 -4.230 0.748
448 2HG2 ILE 54 2HG2 ILE 54 0.883 -4.595 2.471
449 3HG2 ILE 54 3HG2 ILE 54 2.036 -3.400 1.880
450 1HD1 ILE 54 1HD1 ILE 54 2.369 -1.708 0.832
451 2HD1 ILE 54 2HD1 ILE 54 1.753 -0.550 2.013
452 3HD1 ILE 54 3HD1 ILE 54 1.703 -0.169 0.292
453 H THR 55 H THR 55 -1.924 -3.338 4.295
454 HA THR 55 HA THR 55 -1.304 -5.958 4.936
455 HB THR 55 HB THR 55 -2.980 -5.735 6.822
456 HG1 THR 55 1HG THR 55 -3.177 -3.016 6.091
457 1HG2 THR 55 1HG2 THR 55 -0.625 -5.122 7.089
458 2HG2 THR 55 2HG2 THR 55 -1.675 -4.044 8.008
459 3HG2 THR 55 3HG2 THR 55 -0.978 -3.502 6.482
460 H ARG 56 H ARG 56 -4.481 -4.688 3.894
461 HA ARG 56 HA ARG 56 -5.843 -7.145 3.949
462 1HB ARG 56 2HB ARG 56 -6.315 -4.506 2.833
463 2HB ARG 56 1HB ARG 56 -6.908 -5.773 1.767
464 1HG ARG 56 2HG ARG 56 -8.743 -5.384 3.079
465 2HG ARG 56 1HG ARG 56 -7.982 -6.724 3.934
466 1HD ARG 56 2HD ARG 56 -8.582 -5.166 5.596
467 2HD ARG 56 1HD ARG 56 -6.844 -4.972 5.371
468 HE ARG 56 HE ARG 56 -7.269 -2.948 4.164
469 1HH1 ARG 56 1HH1 ARG 56 -10.024 -4.324 5.829
470 2HH1 ARG 56 2HH1 ARG 56 -10.967 -2.865 5.755
471 1HH2 ARG 56 1HH2 ARG 56 -8.501 -0.993 4.093
472 2HH2 ARG 56 2HH2 ARG 56 -10.087 -0.961 4.809
473 H ILE 57 H ILE 57 -3.942 -5.600 1.408
474 HA ILE 57 HA ILE 57 -4.384 -7.518 -0.605
475 HB ILE 57 HB ILE 57 -2.004 -5.693 -0.208
476 1HG1 ILE 57 2HG1 ILE 57 -4.462 -5.398 -1.944
477 2HG1 ILE 57 1HG1 ILE 57 -4.189 -4.550 -0.427
478 1HG2 ILE 57 1HG2 ILE 57 -1.558 -6.036 -2.591
479 2HG2 ILE 57 2HG2 ILE 57 -2.878 -7.202 -2.672
480 3HG2 ILE 57 3HG2 ILE 57 -1.452 -7.553 -1.695
481 1HD1 ILE 57 1HD1 ILE 57 -3.723 -3.102 -2.293
482 2HD1 ILE 57 2HD1 ILE 57 -2.574 -4.268 -2.951
483 3HD1 ILE 57 3HD1 ILE 57 -2.228 -3.453 -1.424
484 H ILE 58 H ILE 58 -1.940 -7.317 1.952
485 HA ILE 58 HA ILE 58 -0.306 -9.436 1.132
486 HB ILE 58 HB ILE 58 -0.908 -8.470 3.936
487 1HG1 ILE 58 2HG1 ILE 58 1.433 -7.925 2.093
488 2HG1 ILE 58 1HG1 ILE 58 0.128 -6.795 2.444
489 1HG2 ILE 58 1HG2 ILE 58 1.306 -10.289 2.988
490 2HG2 ILE 58 2HG2 ILE 58 -0.065 -10.757 3.996
491 3HG2 ILE 58 3HG2 ILE 58 1.140 -9.627 4.616
492 1HD1 ILE 58 1HD1 ILE 58 2.132 -7.868 4.418
493 2HD1 ILE 58 2HD1 ILE 58 0.811 -6.765 4.797
494 3HD1 ILE 58 3HD1 ILE 58 2.108 -6.249 3.721
495 H SER 59 H SER 59 -3.059 -9.461 3.396
496 HA SER 59 HA SER 59 -2.993 -12.242 3.844
497 1HB SER 59 2HB SER 59 -5.334 -11.906 4.707
498 2HB SER 59 1HB SER 59 -4.124 -10.845 5.426
499 HG SER 59 HG SER 59 -5.035 -9.572 3.319
500 H GLN 60 H GLN 60 -4.222 -10.384 1.224
501 HA GLN 60 HA GLN 60 -6.022 -12.443 0.270
502 1HB GLN 60 2HB GLN 60 -6.435 -9.988 -0.024
503 2HB GLN 60 1HB GLN 60 -5.071 -9.937 -1.130
504 1HG GLN 60 2HG GLN 60 -7.104 -10.028 -2.387
505 2HG GLN 60 1HG GLN 60 -6.237 -11.547 -2.593
506 1HE2 GLN 60 1HE2 GLN 60 -8.966 -9.980 -1.121
507 2HE2 GLN 60 2HE2 GLN 60 -9.861 -11.418 -0.765
508 H GLN 61 H GLN 61 -2.993 -10.957 -0.797
509 HA GLN 61 HA GLN 61 -2.700 -12.583 -3.109
510 1HB GLN 61 2HB GLN 61 -1.751 -10.393 -3.104
511 2HB GLN 61 1HB GLN 61 -0.838 -10.721 -1.639
512 1HG GLN 61 2HG GLN 61 0.490 -12.391 -2.909
513 2HG GLN 61 1HG GLN 61 -0.364 -11.891 -4.369
514 1HE2 GLN 61 1HE2 GLN 61 0.071 -9.883 -5.264
515 2HE2 GLN 61 2HE2 GLN 61 1.442 -8.941 -4.806
516 H LYS 62 H LYS 62 -1.491 -12.773 0.174
517 HA LYS 62 HA LYS 62 -0.292 -14.315 1.319
518 1HB LYS 62 2HB LYS 62 -0.554 -16.079 -1.130
519 2HB LYS 62 1HB LYS 62 0.013 -16.587 0.453
520 1HG LYS 62 2HG LYS 62 -2.759 -15.622 -0.222
521 2HG LYS 62 1HG LYS 62 -2.272 -17.290 0.079
522 1HD LYS 62 2HD LYS 62 -1.591 -16.623 2.372
523 2HD LYS 62 1HD LYS 62 -2.228 -15.008 2.049
524 1HE LYS 62 2HE LYS 62 -3.775 -17.596 2.063
525 2HE LYS 62 1HE LYS 62 -3.875 -16.300 3.255
526 1HZ LYS 62 1HZ LYS 62 -4.591 -16.010 0.390
527 2HZ LYS 62 2HZ LYS 62 -4.797 -14.845 1.603
528 3HZ LYS 62 3HZ LYS 62 -5.709 -16.275 1.636
Start of MODEL 12
1 1H MET 1 1HT MET 1 -23.619 -2.230 -11.745
2 2H MET 1 2HT MET 1 -24.559 -3.434 -12.478
3 3H MET 1 3HT MET 1 -24.788 -1.806 -12.900
4 HA MET 1 HA MET 1 -23.551 -3.102 -14.570
5 1HB MET 1 2HB MET 1 -21.826 -1.433 -14.941
6 2HB MET 1 1HB MET 1 -23.291 -0.645 -14.377
7 1HG MET 1 2HG MET 1 -22.345 -0.475 -12.136
8 2HG MET 1 1HG MET 1 -20.879 -1.277 -12.692
9 1HE MET 1 1HE MET 1 -19.413 0.702 -11.733
10 2HE MET 1 2HE MET 1 -20.868 1.528 -11.171
11 3HE MET 1 3HE MET 1 -19.675 2.401 -12.127
12 H GLY 2 H GLY 2 -21.126 -3.597 -15.075
13 1HA GLY 2 2HA GLY 2 -20.296 -5.638 -13.247
14 2HA GLY 2 1HA GLY 2 -19.437 -5.121 -14.694
15 H ASN 3 H ASN 3 -18.464 -5.739 -11.967
16 HA ASN 3 HA ASN 3 -17.479 -3.155 -11.035
17 1HB ASN 3 2HB ASN 3 -18.220 -4.926 -9.424
18 2HB ASN 3 1HB ASN 3 -16.873 -5.922 -9.966
19 1HD2 ASN 3 1HD2 ASN 3 -17.821 -3.100 -8.201
20 2HD2 ASN 3 2HD2 ASN 3 -16.310 -2.828 -7.407
21 H ILE 4 H ILE 4 -15.550 -2.345 -11.598
22 HA ILE 4 HA ILE 4 -13.395 -4.066 -12.443
23 HB ILE 4 HB ILE 4 -14.681 -3.949 -14.512
24 1HG1 ILE 4 2HG1 ILE 4 -12.188 -2.232 -14.613
25 2HG1 ILE 4 1HG1 ILE 4 -12.239 -3.991 -14.691
26 1HG2 ILE 4 1HG2 ILE 4 -15.100 -1.837 -15.652
27 2HG2 ILE 4 2HG2 ILE 4 -14.395 -0.958 -14.296
28 3HG2 ILE 4 3HG2 ILE 4 -15.884 -1.875 -14.072
29 1HD1 ILE 4 1HD1 ILE 4 -13.427 -2.115 -16.722
30 2HD1 ILE 4 2HD1 ILE 4 -13.417 -3.877 -16.806
31 3HD1 ILE 4 3HD1 ILE 4 -11.901 -2.981 -16.880
32 H ARG 5 H ARG 5 -11.426 -3.107 -12.371
33 HA ARG 5 HA ARG 5 -9.785 -1.567 -12.294
34 1HB ARG 5 2HB ARG 5 -11.008 -0.244 -13.921
35 2HB ARG 5 1HB ARG 5 -11.974 0.478 -12.643
36 1HG ARG 5 2HG ARG 5 -10.121 1.671 -11.786
37 2HG ARG 5 1HG ARG 5 -8.984 0.755 -12.778
38 1HD ARG 5 2HD ARG 5 -11.127 2.583 -13.857
39 2HD ARG 5 1HD ARG 5 -9.437 3.036 -13.641
40 HE ARG 5 HE ARG 5 -8.945 1.154 -15.246
41 1HH1 ARG 5 1HH1 ARG 5 -12.029 2.828 -15.277
42 2HH1 ARG 5 2HH1 ARG 5 -12.312 2.529 -16.972
43 1HH2 ARG 5 1HH2 ARG 5 -9.312 0.762 -17.448
44 2HH2 ARG 5 2HH2 ARG 5 -10.770 1.344 -18.207
45 H THR 6 H THR 6 -8.659 -1.022 -10.672
46 HA THR 6 HA THR 6 -9.552 0.617 -8.490
47 HB THR 6 HB THR 6 -8.553 -1.287 -6.892
48 HG1 THR 6 1HG THR 6 -10.023 -3.147 -8.131
49 1HG2 THR 6 1HG2 THR 6 -10.836 -1.950 -6.306
50 2HG2 THR 6 2HG2 THR 6 -11.431 -1.257 -7.814
51 3HG2 THR 6 3HG2 THR 6 -10.724 -0.214 -6.580
52 H SER 7 H SER 7 -7.663 0.445 -10.689
53 HA SER 7 HA SER 7 -5.159 -0.574 -9.807
54 1HB SER 7 2HB SER 7 -5.580 1.139 -12.239
55 2HB SER 7 1HB SER 7 -4.472 -0.219 -12.018
56 HG SER 7 HG SER 7 -6.013 -1.321 -12.950
57 H PHE 8 H PHE 8 -6.664 2.556 -9.648
58 HA PHE 8 HA PHE 8 -4.299 4.112 -9.820
59 1HB PHE 8 2HB PHE 8 -6.985 4.712 -8.583
60 2HB PHE 8 1HB PHE 8 -5.679 5.890 -8.658
61 HD1 PHE 8 1HD PHE 8 -8.624 5.340 -10.057
62 HD2 PHE 8 2HD PHE 8 -4.558 5.570 -11.280
63 HE1 PHE 8 1HE PHE 8 -9.346 5.973 -12.324
64 HE2 PHE 8 2HE PHE 8 -5.270 6.202 -13.547
65 HZ PHE 8 HZ PHE 8 -7.667 6.405 -14.073
66 H VAL 9 H VAL 9 -6.225 3.294 -6.929
67 HA VAL 9 HA VAL 9 -4.217 4.101 -5.097
68 HB VAL 9 HB VAL 9 -6.496 2.159 -4.643
69 1HG1 VAL 9 1HG1 VAL 9 -6.277 2.776 -2.281
70 2HG1 VAL 9 2HG1 VAL 9 -4.870 3.767 -2.672
71 3HG1 VAL 9 3HG1 VAL 9 -4.809 2.019 -2.898
72 1HG2 VAL 9 1HG2 VAL 9 -7.705 4.111 -3.752
73 2HG2 VAL 9 2HG2 VAL 9 -7.327 4.275 -5.466
74 3HG2 VAL 9 3HG2 VAL 9 -6.374 5.149 -4.268
75 H LYS 10 H LYS 10 -4.972 1.084 -6.685
76 HA LYS 10 HA LYS 10 -3.378 -0.630 -5.104
77 1HB LYS 10 2HB LYS 10 -5.254 -1.212 -6.738
78 2HB LYS 10 1HB LYS 10 -4.064 -1.014 -8.015
79 1HG LYS 10 2HG LYS 10 -2.795 -2.852 -7.248
80 2HG LYS 10 1HG LYS 10 -3.696 -2.928 -5.729
81 1HD LYS 10 2HD LYS 10 -5.729 -3.513 -6.976
82 2HD LYS 10 1HD LYS 10 -4.816 -3.452 -8.484
83 1HE LYS 10 2HE LYS 10 -4.161 -5.298 -6.195
84 2HE LYS 10 1HE LYS 10 -5.179 -5.750 -7.560
85 1HZ LYS 10 1HZ LYS 10 -3.345 -5.364 -9.050
86 2HZ LYS 10 2HZ LYS 10 -2.877 -6.463 -7.843
87 3HZ LYS 10 3HZ LYS 10 -2.361 -4.852 -7.771
88 H ARG 11 H ARG 11 -2.710 1.374 -7.919
89 HA ARG 11 HA ARG 11 -0.095 0.337 -8.405
90 1HB ARG 11 2HB ARG 11 -1.364 1.470 -10.159
91 2HB ARG 11 1HB ARG 11 -1.355 2.959 -9.229
92 1HG ARG 11 2HG ARG 11 1.051 3.130 -9.480
93 2HG ARG 11 1HG ARG 11 1.086 1.589 -10.340
94 1HD ARG 11 2HD ARG 11 -0.420 4.038 -11.251
95 2HD ARG 11 1HD ARG 11 1.171 3.561 -11.840
96 HE ARG 11 HE ARG 11 -0.132 1.381 -12.440
97 1HH1 ARG 11 1HH1 ARG 11 -1.290 4.678 -12.736
98 2HH1 ARG 11 2HH1 ARG 11 -2.333 4.325 -14.081
99 1HH2 ARG 11 1HH2 ARG 11 -1.489 0.919 -14.211
100 2HH2 ARG 11 2HH2 ARG 11 -2.463 2.185 -14.900
101 H ILE 12 H ILE 12 -1.392 3.001 -6.501
102 HA ILE 12 HA ILE 12 0.985 4.296 -5.826
103 HB ILE 12 HB ILE 12 -1.439 3.895 -4.060
104 1HG1 ILE 12 2HG1 ILE 12 -0.741 6.171 -5.927
105 2HG1 ILE 12 1HG1 ILE 12 -1.939 4.926 -6.262
106 1HG2 ILE 12 1HG2 ILE 12 -0.685 5.909 -2.895
107 2HG2 ILE 12 2HG2 ILE 12 0.751 5.968 -3.918
108 3HG2 ILE 12 3HG2 ILE 12 0.520 4.624 -2.798
109 1HD1 ILE 12 1HD1 ILE 12 -2.999 6.969 -5.520
110 2HD1 ILE 12 2HD1 ILE 12 -2.055 6.940 -4.031
111 3HD1 ILE 12 3HD1 ILE 12 -3.249 5.680 -4.343
112 H ALA 13 H ALA 13 -0.680 1.640 -4.146
113 HA ALA 13 HA ALA 13 1.296 1.240 -2.174
114 1HB ALA 13 1HB ALA 13 0.209 -0.895 -1.756
115 2HB ALA 13 2HB ALA 13 -0.665 -0.769 -3.282
116 3HB ALA 13 3HB ALA 13 -0.995 0.373 -1.980
117 H LYS 14 H LYS 14 0.834 -0.106 -5.390
118 HA LYS 14 HA LYS 14 2.826 -2.094 -5.245
119 1HB LYS 14 2HB LYS 14 0.941 -1.888 -6.931
120 2HB LYS 14 1HB LYS 14 1.907 -0.668 -7.744
121 1HG LYS 14 2HG LYS 14 3.134 -3.324 -7.214
122 2HG LYS 14 1HG LYS 14 1.933 -3.186 -8.496
123 1HD LYS 14 2HD LYS 14 3.254 -1.457 -9.580
124 2HD LYS 14 1HD LYS 14 4.438 -1.515 -8.269
125 1HE LYS 14 2HE LYS 14 5.021 -3.782 -8.833
126 2HE LYS 14 1HE LYS 14 3.735 -3.855 -10.036
127 1HZ LYS 14 1HZ LYS 14 6.087 -2.034 -10.165
128 2HZ LYS 14 2HZ LYS 14 4.880 -2.220 -11.349
129 3HZ LYS 14 3HZ LYS 14 5.937 -3.498 -11.008
130 H GLU 15 H GLU 15 2.927 1.318 -6.090
131 HA GLU 15 HA GLU 15 5.567 1.308 -7.147
132 1HB GLU 15 2HB GLU 15 3.876 3.083 -7.583
133 2HB GLU 15 1HB GLU 15 4.044 3.608 -5.914
134 1HG GLU 15 2HG GLU 15 6.375 4.158 -6.299
135 2HG GLU 15 1HG GLU 15 6.247 3.589 -7.962
136 H MET 16 H MET 16 4.221 1.768 -3.938
137 HA MET 16 HA MET 16 6.654 2.536 -2.666
138 1HB MET 16 2HB MET 16 4.512 3.039 -1.649
139 2HB MET 16 1HB MET 16 4.111 1.331 -1.561
140 1HG MET 16 2HG MET 16 5.867 0.963 0.051
141 2HG MET 16 1HG MET 16 6.384 2.641 -0.091
142 1HE MET 16 1HE MET 16 5.016 4.702 0.789
143 2HE MET 16 2HE MET 16 3.394 4.587 1.473
144 3HE MET 16 3HE MET 16 3.661 4.224 -0.233
145 H ILE 17 H ILE 17 4.979 -0.556 -3.112
146 HA ILE 17 HA ILE 17 6.897 -2.068 -1.605
147 HB ILE 17 HB ILE 17 4.831 -3.086 -3.578
148 1HG1 ILE 17 2HG1 ILE 17 4.604 -2.719 -0.582
149 2HG1 ILE 17 1HG1 ILE 17 3.841 -1.686 -1.787
150 1HG2 ILE 17 1HG2 ILE 17 4.967 -5.178 -2.313
151 2HG2 ILE 17 2HG2 ILE 17 6.229 -4.485 -1.294
152 3HG2 ILE 17 3HG2 ILE 17 6.529 -4.752 -3.012
153 1HD1 ILE 17 1HD1 ILE 17 2.258 -3.271 -0.858
154 2HD1 ILE 17 2HD1 ILE 17 3.287 -4.615 -1.357
155 3HD1 ILE 17 3HD1 ILE 17 2.526 -3.588 -2.573
156 H GLU 18 H GLU 18 7.101 -0.615 -4.558
157 HA GLU 18 HA GLU 18 8.242 -2.608 -6.196
158 1HB GLU 18 2HB GLU 18 7.292 -0.386 -6.933
159 2HB GLU 18 1HB GLU 18 8.772 0.358 -6.350
160 1HG GLU 18 2HG GLU 18 9.063 0.090 -8.655
161 2HG GLU 18 1HG GLU 18 10.016 -1.192 -7.907
162 H THR 19 H THR 19 10.215 -3.427 -6.304
163 HA THR 19 HA THR 19 12.479 -3.559 -6.364
164 HB THR 19 HB THR 19 12.524 -0.769 -5.204
165 HG1 THR 19 1HG THR 19 11.588 -1.346 -7.450
166 1HG2 THR 19 1HG2 THR 19 14.824 -0.688 -6.010
167 2HG2 THR 19 2HG2 THR 19 14.694 -2.342 -6.606
168 3HG2 THR 19 3HG2 THR 19 14.629 -2.024 -4.874
169 H HIS 20 H HIS 20 11.720 -1.766 -3.320
170 HA HIS 20 HA HIS 20 13.815 -3.375 -2.081
171 1HB HIS 20 2HB HIS 20 13.407 -0.749 -1.860
172 2HB HIS 20 1HB HIS 20 12.426 -1.278 -0.497
173 HD1 HIS 20 1HD HIS 20 15.504 0.112 -0.838
174 HD2 HIS 20 2HD HIS 20 14.346 -3.534 0.806
175 HE1 HIS 20 1HE HIS 20 17.354 -0.548 0.721
176 HE2 HIS 20 2HE HIS 20 16.756 -2.869 1.486
177 HA PRO 21 HA PRO 21 10.160 -4.342 1.007
178 1HB PRO 21 2HB PRO 21 7.834 -3.689 -0.719
179 2HB PRO 21 1HB PRO 21 8.049 -3.453 1.018
180 1HG PRO 21 2HG PRO 21 8.157 -1.374 -0.618
181 2HG PRO 21 1HG PRO 21 9.305 -1.512 0.730
182 1HD PRO 21 2HD PRO 21 9.720 -2.119 -2.183
183 2HD PRO 21 1HD PRO 21 10.785 -1.249 -1.057
184 H GLY 22 H GLY 22 9.775 -6.477 1.093
185 1HA GLY 22 2HA GLY 22 9.511 -7.887 -1.477
186 2HA GLY 22 1HA GLY 22 10.213 -8.565 -0.020
187 H LYS 23 H LYS 23 7.626 -7.024 1.109
188 HA LYS 23 HA LYS 23 5.826 -7.863 2.224
189 1HB LYS 23 2HB LYS 23 3.932 -8.433 0.764
190 2HB LYS 23 1HB LYS 23 4.783 -6.997 0.218
191 1HG LYS 23 2HG LYS 23 5.762 -8.171 -1.597
192 2HG LYS 23 1HG LYS 23 5.234 -9.727 -0.960
193 1HD LYS 23 2HD LYS 23 2.883 -9.001 -1.278
194 2HD LYS 23 1HD LYS 23 3.482 -7.522 -2.034
195 1HE LYS 23 2HE LYS 23 4.561 -8.815 -3.777
196 2HE LYS 23 1HE LYS 23 4.070 -10.321 -3.003
197 1HZ LYS 23 1HZ LYS 23 2.655 -9.685 -4.895
198 2HZ LYS 23 2HZ LYS 23 2.190 -8.280 -4.068
199 3HZ LYS 23 3HZ LYS 23 1.782 -9.805 -3.445
200 H PHE 24 H PHE 24 6.715 -9.512 3.479
201 HA PHE 24 HA PHE 24 6.105 -12.208 2.496
202 1HB PHE 24 2HB PHE 24 8.136 -13.001 3.786
203 2HB PHE 24 1HB PHE 24 8.461 -12.088 2.318
204 HD1 PHE 24 1HD PHE 24 8.729 -12.151 5.946
205 HD2 PHE 24 2HD PHE 24 9.358 -9.812 2.441
206 HE1 PHE 24 1HE PHE 24 10.167 -10.624 7.227
207 HE2 PHE 24 2HE PHE 24 10.798 -8.282 3.721
208 HZ PHE 24 HZ PHE 24 11.207 -8.690 6.115
209 H THR 25 H THR 25 5.273 -9.985 4.707
210 HA THR 25 HA THR 25 4.295 -12.055 6.525
211 HB THR 25 HB THR 25 5.456 -9.468 7.585
212 HG1 THR 25 1HG THR 25 6.635 -12.076 7.520
213 1HG2 THR 25 1HG2 THR 25 4.670 -12.034 8.983
214 2HG2 THR 25 2HG2 THR 25 3.737 -10.536 8.992
215 3HG2 THR 25 3HG2 THR 25 5.327 -10.589 9.754
216 H ASP 26 H ASP 26 2.299 -11.534 7.509
217 HA ASP 26 HA ASP 26 0.879 -9.361 6.138
218 1HB ASP 26 2HB ASP 26 -1.166 -10.641 6.588
219 2HB ASP 26 1HB ASP 26 0.014 -11.623 5.728
220 H ASP 27 H ASP 27 2.502 -8.974 8.561
221 HA ASP 27 HA ASP 27 0.447 -8.379 10.574
222 1HB ASP 27 2HB ASP 27 2.498 -9.648 11.269
223 2HB ASP 27 1HB ASP 27 3.461 -8.232 10.862
224 H PHE 28 H PHE 28 0.585 -6.240 11.675
225 HA PHE 28 HA PHE 28 0.659 -4.171 9.712
226 1HB PHE 28 2HB PHE 28 0.122 -4.196 12.669
227 2HB PHE 28 1HB PHE 28 0.221 -2.685 11.770
228 HD1 PHE 28 1HD PHE 28 -1.514 -2.018 10.275
229 HD2 PHE 28 2HD PHE 28 -1.671 -5.802 12.208
230 HE1 PHE 28 1HE PHE 28 -3.863 -2.265 9.588
231 HE2 PHE 28 2HE PHE 28 -4.020 -6.060 11.525
232 HZ PHE 28 HZ PHE 28 -5.119 -4.288 10.213
233 H ASP 29 H ASP 29 2.948 -5.358 12.041
234 HA ASP 29 HA ASP 29 4.637 -3.067 12.081
235 1HB ASP 29 2HB ASP 29 4.821 -4.905 13.724
236 2HB ASP 29 1HB ASP 29 5.375 -5.980 12.444
237 H THR 30 H THR 30 4.129 -5.684 9.876
238 HA THR 30 HA THR 30 6.450 -5.448 8.308
239 HB THR 30 HB THR 30 3.735 -6.347 7.343
240 HG1 THR 30 1HG THR 30 5.753 -7.768 8.793
241 1HG2 THR 30 1HG2 THR 30 6.542 -7.099 6.522
242 2HG2 THR 30 2HG2 THR 30 5.422 -6.105 5.591
243 3HG2 THR 30 3HG2 THR 30 5.066 -7.811 5.874
244 H ASN 31 H ASN 31 3.159 -4.094 7.831
245 HA ASN 31 HA ASN 31 3.893 -2.765 5.442
246 1HB ASN 31 2HB ASN 31 1.752 -1.633 5.528
247 2HB ASN 31 1HB ASN 31 1.546 -3.327 5.930
248 1HD2 ASN 31 1HD2 ASN 31 -0.364 -3.073 6.993
249 2HD2 ASN 31 2HD2 ASN 31 -0.505 -2.250 8.507
250 H LYS 32 H LYS 32 4.058 -1.874 8.791
251 HA LYS 32 HA LYS 32 4.626 0.865 8.502
252 1HB LYS 32 2HB LYS 32 4.139 -0.256 10.657
253 2HB LYS 32 1HB LYS 32 5.681 -1.091 10.558
254 1HG LYS 32 2HG LYS 32 6.543 1.429 10.340
255 2HG LYS 32 1HG LYS 32 5.078 1.703 11.285
256 1HD LYS 32 2HD LYS 32 6.887 1.370 12.814
257 2HD LYS 32 1HD LYS 32 5.867 -0.071 12.865
258 1HE LYS 32 2HE LYS 32 7.435 -1.097 11.180
259 2HE LYS 32 1HE LYS 32 8.503 0.279 11.450
260 1HZ LYS 32 1HZ LYS 32 7.685 -1.791 13.405
261 2HZ LYS 32 2HZ LYS 32 8.487 -0.363 13.854
262 3HZ LYS 32 3HZ LYS 32 9.246 -1.476 12.818
263 H LYS 33 H LYS 33 6.689 -2.004 8.507
264 HA LYS 33 HA LYS 33 9.174 -0.685 8.241
265 1HB LYS 33 2HB LYS 33 8.421 -3.231 8.721
266 2HB LYS 33 1HB LYS 33 8.810 -3.371 7.016
267 1HG LYS 33 2HG LYS 33 10.697 -2.335 9.120
268 2HG LYS 33 1HG LYS 33 10.664 -3.996 8.531
269 1HD LYS 33 2HD LYS 33 11.051 -3.008 6.211
270 2HD LYS 33 1HD LYS 33 11.416 -1.492 7.041
271 1HE LYS 33 2HE LYS 33 13.148 -2.682 8.357
272 2HE LYS 33 1HE LYS 33 12.831 -4.133 7.410
273 1HZ LYS 33 1HZ LYS 33 14.619 -3.237 6.323
274 2HZ LYS 33 2HZ LYS 33 14.151 -1.636 6.605
275 3HZ LYS 33 3HZ LYS 33 13.355 -2.551 5.420
276 H LEU 34 H LEU 34 6.742 -1.740 5.949
277 HA LEU 34 HA LEU 34 8.358 -1.482 3.623
278 1HB LEU 34 2HB LEU 34 5.348 -1.427 3.844
279 2HB LEU 34 1HB LEU 34 6.271 -1.698 2.379
280 HG LEU 34 HG LEU 34 6.096 -3.531 4.770
281 1HD1 LEU 34 1HD1 LEU 34 5.052 -5.073 3.222
282 2HD1 LEU 34 2HD1 LEU 34 5.214 -3.900 1.914
283 3HD1 LEU 34 3HD1 LEU 34 4.152 -3.556 3.282
284 1HD2 LEU 34 1HD2 LEU 34 7.720 -3.860 2.249
285 2HD2 LEU 34 2HD2 LEU 34 7.523 -5.064 3.522
286 3HD2 LEU 34 3HD2 LEU 34 8.365 -3.553 3.862
287 H VAL 35 H VAL 35 5.957 0.654 5.160
288 HA VAL 35 HA VAL 35 6.237 2.738 3.239
289 HB VAL 35 HB VAL 35 5.298 2.957 6.109
290 1HG1 VAL 35 1HG1 VAL 35 5.878 5.117 5.142
291 2HG1 VAL 35 2HG1 VAL 35 4.135 4.970 5.361
292 3HG1 VAL 35 3HG1 VAL 35 4.839 4.785 3.755
293 1HG2 VAL 35 1HG2 VAL 35 3.964 1.328 4.918
294 2HG2 VAL 35 2HG2 VAL 35 3.732 2.452 3.578
295 3HG2 VAL 35 3HG2 VAL 35 3.028 2.800 5.157
296 H GLU 36 H GLU 36 7.916 1.884 6.185
297 HA GLU 36 HA GLU 36 9.461 4.280 6.368
298 1HB GLU 36 2HB GLU 36 9.097 2.785 8.297
299 2HB GLU 36 1HB GLU 36 10.014 1.523 7.490
300 1HG GLU 36 2HG GLU 36 11.999 2.979 7.528
301 2HG GLU 36 1HG GLU 36 11.065 4.190 8.405
302 H GLU 37 H GLU 37 9.603 1.418 4.494
303 HA GLU 37 HA GLU 37 12.400 1.583 3.840
304 1HB GLU 37 2HB GLU 37 10.849 -0.511 3.842
305 2HB GLU 37 1HB GLU 37 10.361 0.052 2.250
306 1HG GLU 37 2HG GLU 37 12.071 -1.555 1.946
307 2HG GLU 37 1HG GLU 37 12.771 0.026 1.594
308 H PHE 38 H PHE 38 9.368 2.018 2.033
309 HA PHE 38 HA PHE 38 10.735 3.996 0.343
310 1HB PHE 38 2HB PHE 38 10.492 1.711 -0.774
311 2HB PHE 38 1HB PHE 38 8.754 1.986 -0.743
312 HD1 PHE 38 1HD PHE 38 7.732 3.635 -2.192
313 HD2 PHE 38 2HD PHE 38 11.935 2.980 -2.233
314 HE1 PHE 38 1HE PHE 38 7.899 4.866 -4.316
315 HE2 PHE 38 2HE PHE 38 12.110 4.209 -4.359
316 HZ PHE 38 HZ PHE 38 10.091 5.153 -5.401
317 H SER 39 H SER 39 9.311 5.623 -0.495
318 HA SER 39 HA SER 39 6.603 5.768 0.380
319 1HB SER 39 2HB SER 39 6.997 7.739 1.922
320 2HB SER 39 1HB SER 39 7.537 6.182 2.552
321 HG SER 39 HG SER 39 9.560 6.811 2.436
322 H THR 40 H THR 40 5.536 7.654 -0.351
323 HA THR 40 HA THR 40 7.100 9.455 -2.061
324 HB THR 40 HB THR 40 4.426 8.252 -2.831
325 HG1 THR 40 1HG THR 40 5.700 7.146 -4.436
326 1HG2 THR 40 1HG2 THR 40 4.728 10.484 -3.739
327 2HG2 THR 40 2HG2 THR 40 4.903 9.293 -5.030
328 3HG2 THR 40 3HG2 THR 40 6.332 10.055 -4.330
329 H VAL 41 H VAL 41 6.788 11.480 -1.394
330 HA VAL 41 HA VAL 41 5.798 13.398 -0.671
331 HB VAL 41 HB VAL 41 3.201 11.842 -0.799
332 1HG1 VAL 41 1HG1 VAL 41 2.063 13.977 -0.755
333 2HG1 VAL 41 2HG1 VAL 41 3.605 14.823 -0.621
334 3HG1 VAL 41 3HG1 VAL 41 3.051 13.787 0.696
335 1HG2 VAL 41 1HG2 VAL 41 2.831 13.035 -2.908
336 2HG2 VAL 41 2HG2 VAL 41 4.270 12.018 -2.976
337 3HG2 VAL 41 3HG2 VAL 41 4.432 13.763 -2.771
338 H SER 42 H SER 42 5.165 14.355 1.333
339 HA SER 42 HA SER 42 5.694 12.842 3.664
340 1HB SER 42 2HB SER 42 4.286 15.519 3.497
341 2HB SER 42 1HB SER 42 5.146 14.858 4.887
342 HG SER 42 HG SER 42 6.105 16.189 2.700
343 H THR 43 H THR 43 4.356 11.190 4.102
344 HA THR 43 HA THR 43 1.520 11.400 3.610
345 HB THR 43 HB THR 43 1.506 9.019 4.411
346 HG1 THR 43 1HG THR 43 3.602 9.485 5.628
347 1HG2 THR 43 1HG2 THR 43 2.696 8.127 2.452
348 2HG2 THR 43 2HG2 THR 43 3.462 9.698 2.209
349 3HG2 THR 43 3HG2 THR 43 1.714 9.532 2.034
350 H LYS 44 H LYS 44 0.302 12.418 5.066
351 HA LYS 44 HA LYS 44 0.872 12.061 7.920
352 1HB LYS 44 2HB LYS 44 0.472 14.357 6.957
353 2HB LYS 44 1HB LYS 44 -1.184 13.868 6.633
354 1HG LYS 44 2HG LYS 44 -1.090 15.152 8.669
355 2HG LYS 44 1HG LYS 44 -1.523 13.480 9.038
356 1HD LYS 44 2HD LYS 44 0.746 13.011 9.737
357 2HD LYS 44 1HD LYS 44 1.259 14.631 9.260
358 1HE LYS 44 2HE LYS 44 -0.788 14.018 11.385
359 2HE LYS 44 1HE LYS 44 0.903 14.400 11.700
360 1HZ LYS 44 1HZ LYS 44 -0.496 16.336 11.971
361 2HZ LYS 44 2HZ LYS 44 -1.068 16.192 10.381
362 3HZ LYS 44 3HZ LYS 44 0.564 16.558 10.667
363 H HIS 45 H HIS 45 -2.234 12.471 6.253
364 HA HIS 45 HA HIS 45 -3.202 10.045 7.603
365 1HB HIS 45 2HB HIS 45 -4.589 12.464 6.491
366 2HB HIS 45 1HB HIS 45 -5.472 10.957 6.704
367 HD1 HIS 45 1HD HIS 45 -4.370 13.928 8.505
368 HD2 HIS 45 2HD HIS 45 -5.507 10.044 9.473
369 HE1 HIS 45 1HE HIS 45 -4.852 13.953 10.974
370 HE2 HIS 45 2HE HIS 45 -5.767 11.660 11.477
371 H LEU 46 H LEU 46 -1.631 10.592 4.975
372 HA LEU 46 HA LEU 46 -3.245 8.974 3.160
373 1HB LEU 46 2HB LEU 46 -2.020 10.919 2.280
374 2HB LEU 46 1HB LEU 46 -0.512 10.227 2.839
375 HG LEU 46 HG LEU 46 -0.835 8.337 1.261
376 1HD1 LEU 46 1HD1 LEU 46 -2.499 8.569 -0.521
377 2HD1 LEU 46 2HD1 LEU 46 -3.165 9.983 0.296
378 3HD1 LEU 46 3HD1 LEU 46 -3.250 8.399 1.065
379 1HD2 LEU 46 1HD2 LEU 46 -0.314 9.622 -0.761
380 2HD2 LEU 46 2HD2 LEU 46 0.564 10.219 0.645
381 3HD2 LEU 46 3HD2 LEU 46 -0.844 11.098 0.047
382 H ARG 47 H ARG 47 -0.611 8.755 5.381
383 HA ARG 47 HA ARG 47 0.712 6.502 4.304
384 1HB ARG 47 2HB ARG 47 1.844 8.008 5.822
385 2HB ARG 47 1HB ARG 47 0.697 7.635 7.101
386 1HG ARG 47 2HG ARG 47 1.537 5.423 7.321
387 2HG ARG 47 1HG ARG 47 2.520 5.591 5.867
388 1HD ARG 47 2HD ARG 47 3.836 5.803 7.948
389 2HD ARG 47 1HD ARG 47 3.910 7.243 6.935
390 HE ARG 47 HE ARG 47 1.836 7.527 8.831
391 1HH1 ARG 47 1HH1 ARG 47 5.332 7.490 8.619
392 2HH1 ARG 47 2HH1 ARG 47 5.562 8.516 10.002
393 1HH2 ARG 47 1HH2 ARG 47 2.120 8.869 10.635
394 2HH2 ARG 47 2HH2 ARG 47 3.719 9.297 11.163
395 H ASN 48 H ASN 48 -1.675 6.832 6.911
396 HA ASN 48 HA ASN 48 -1.701 4.128 7.681
397 1HB ASN 48 2HB ASN 48 -3.864 4.654 8.770
398 2HB ASN 48 1HB ASN 48 -2.623 5.845 9.133
399 1HD2 ASN 48 1HD2 ASN 48 -5.552 6.064 9.222
400 2HD2 ASN 48 2HD2 ASN 48 -5.958 7.389 8.182
401 H LYS 49 H LYS 49 -3.463 5.880 5.210
402 HA LYS 49 HA LYS 49 -5.287 3.835 4.540
403 1HB LYS 49 2HB LYS 49 -4.179 6.149 2.952
404 2HB LYS 49 1HB LYS 49 -5.399 5.055 2.320
405 1HG LYS 49 2HG LYS 49 -5.723 6.674 4.830
406 2HG LYS 49 1HG LYS 49 -6.308 7.165 3.239
407 1HD LYS 49 2HD LYS 49 -7.699 5.155 3.130
408 2HD LYS 49 1HD LYS 49 -7.110 4.664 4.721
409 1HE LYS 49 2HE LYS 49 -8.105 6.593 5.738
410 2HE LYS 49 1HE LYS 49 -8.571 7.235 4.166
411 1HZ LYS 49 1HZ LYS 49 -10.426 6.172 5.328
412 2HZ LYS 49 2HZ LYS 49 -9.584 4.696 5.339
413 3HZ LYS 49 3HZ LYS 49 -10.071 5.382 3.869
414 H ILE 50 H ILE 50 -2.158 4.746 3.112
415 HA ILE 50 HA ILE 50 -2.150 2.692 1.173
416 HB ILE 50 HB ILE 50 0.219 4.153 2.353
417 1HG1 ILE 50 2HG1 ILE 50 -1.399 4.726 -0.141
418 2HG1 ILE 50 1HG1 ILE 50 -1.477 5.650 1.354
419 1HG2 ILE 50 1HG2 ILE 50 1.374 3.514 0.287
420 2HG2 ILE 50 2HG2 ILE 50 -0.042 2.592 -0.215
421 3HG2 ILE 50 3HG2 ILE 50 0.869 2.097 1.211
422 1HD1 ILE 50 1HD1 ILE 50 -0.119 6.781 -0.298
423 2HD1 ILE 50 2HD1 ILE 50 0.926 5.368 -0.431
424 3HD1 ILE 50 3HD1 ILE 50 0.866 6.282 1.077
425 H ALA 51 H ALA 51 -0.509 2.932 4.333
426 HA ALA 51 HA ALA 51 0.825 0.484 4.250
427 1HB ALA 51 1HB ALA 51 1.289 2.222 5.912
428 2HB ALA 51 2HB ALA 51 0.987 0.662 6.676
429 3HB ALA 51 3HB ALA 51 -0.267 1.902 6.678
430 H GLY 52 H GLY 52 -2.366 1.250 5.626
431 1HA GLY 52 2HA GLY 52 -2.994 -1.359 6.483
432 2HA GLY 52 1HA GLY 52 -4.157 -0.083 6.142
433 H TYR 53 H TYR 53 -3.472 0.289 3.398
434 HA TYR 53 HA TYR 53 -5.123 -1.730 2.276
435 1HB TYR 53 2HB TYR 53 -4.581 0.804 1.559
436 2HB TYR 53 1HB TYR 53 -3.482 -0.038 0.471
437 HD1 TYR 53 1HD TYR 53 -4.324 -1.329 -1.384
438 HD2 TYR 53 2HD TYR 53 -7.004 0.451 1.399
439 HE1 TYR 53 1HE TYR 53 -6.205 -1.787 -2.907
440 HE2 TYR 53 2HE TYR 53 -8.888 0.005 -0.114
441 HH TYR 53 HH TYR 53 -9.287 -0.386 -2.499
442 H ILE 54 H ILE 54 -1.647 -1.165 2.364
443 HA ILE 54 HA ILE 54 -0.794 -3.066 0.511
444 HB ILE 54 HB ILE 54 0.500 -2.225 3.112
445 1HG1 ILE 54 2HG1 ILE 54 1.097 -1.457 0.247
446 2HG1 ILE 54 1HG1 ILE 54 0.215 -0.458 1.397
447 1HG2 ILE 54 1HG2 ILE 54 1.313 -4.435 2.451
448 2HG2 ILE 54 2HG2 ILE 54 2.567 -3.209 2.263
449 3HG2 ILE 54 3HG2 ILE 54 1.705 -3.814 0.849
450 1HD1 ILE 54 1HD1 ILE 54 2.199 -0.336 2.810
451 2HD1 ILE 54 2HD1 ILE 54 2.515 0.273 1.186
452 3HD1 ILE 54 3HD1 ILE 54 3.082 -1.329 1.653
453 H THR 55 H THR 55 -1.212 -3.487 4.033
454 HA THR 55 HA THR 55 -0.855 -6.280 4.008
455 HB THR 55 HB THR 55 -2.380 -5.990 6.192
456 HG1 THR 55 1HG THR 55 -2.875 -3.780 5.698
457 1HG2 THR 55 1HG2 THR 55 -0.312 -5.480 7.424
458 2HG2 THR 55 2HG2 THR 55 0.469 -5.022 5.910
459 3HG2 THR 55 3HG2 THR 55 -0.041 -6.690 6.169
460 H ARG 56 H ARG 56 -3.661 -4.262 3.467
461 HA ARG 56 HA ARG 56 -5.663 -6.227 3.640
462 1HB ARG 56 2HB ARG 56 -5.928 -3.687 3.460
463 2HB ARG 56 1HB ARG 56 -5.697 -3.893 1.730
464 1HG ARG 56 2HG ARG 56 -8.025 -3.778 2.119
465 2HG ARG 56 1HG ARG 56 -7.649 -5.462 1.750
466 1HD ARG 56 2HD ARG 56 -7.712 -6.029 4.100
467 2HD ARG 56 1HD ARG 56 -7.960 -4.338 4.532
468 HE ARG 56 HE ARG 56 -9.929 -5.792 2.891
469 1HH1 ARG 56 1HH1 ARG 56 -9.116 -3.903 5.735
470 2HH1 ARG 56 2HH1 ARG 56 -10.762 -3.744 6.254
471 1HH2 ARG 56 1HH2 ARG 56 -12.081 -5.598 3.570
472 2HH2 ARG 56 2HH2 ARG 56 -12.458 -4.728 5.032
473 H ILE 57 H ILE 57 -3.750 -5.055 0.886
474 HA ILE 57 HA ILE 57 -4.839 -6.755 -1.075
475 HB ILE 57 HB ILE 57 -2.095 -5.500 -0.929
476 1HG1 ILE 57 2HG1 ILE 57 -4.583 -4.658 -2.439
477 2HG1 ILE 57 1HG1 ILE 57 -3.998 -3.908 -0.958
478 1HG2 ILE 57 1HG2 ILE 57 -1.984 -5.896 -3.357
479 2HG2 ILE 57 2HG2 ILE 57 -3.495 -6.799 -3.262
480 3HG2 ILE 57 3HG2 ILE 57 -2.057 -7.399 -2.437
481 1HD1 ILE 57 1HD1 ILE 57 -2.552 -3.972 -3.597
482 2HD1 ILE 57 2HD1 ILE 57 -1.958 -3.227 -2.111
483 3HD1 ILE 57 3HD1 ILE 57 -3.401 -2.590 -2.902
484 H ILE 58 H ILE 58 -2.139 -7.179 1.174
485 HA ILE 58 HA ILE 58 -1.127 -9.588 0.175
486 HB ILE 58 HB ILE 58 -1.223 -8.628 3.045
487 1HG1 ILE 58 2HG1 ILE 58 0.963 -8.475 0.953
488 2HG1 ILE 58 1HG1 ILE 58 -0.027 -7.125 1.502
489 1HG2 ILE 58 1HG2 ILE 58 0.407 -10.839 1.793
490 2HG2 ILE 58 2HG2 ILE 58 -0.866 -11.023 3.000
491 3HG2 ILE 58 3HG2 ILE 58 0.639 -10.206 3.425
492 1HD1 ILE 58 1HD1 ILE 58 1.939 -8.697 3.155
493 2HD1 ILE 58 2HD1 ILE 58 0.918 -7.389 3.753
494 3HD1 ILE 58 3HD1 ILE 58 2.149 -7.059 2.537
495 H SER 59 H SER 59 -3.555 -9.076 2.746
496 HA SER 59 HA SER 59 -4.196 -11.805 3.062
497 1HB SER 59 2HB SER 59 -6.271 -10.906 4.193
498 2HB SER 59 1HB SER 59 -4.745 -10.296 4.831
499 HG SER 59 HG SER 59 -5.532 -8.686 2.854
500 H GLN 60 H GLN 60 -5.058 -9.561 0.629
501 HA GLN 60 HA GLN 60 -7.460 -10.959 -0.189
502 1HB GLN 60 2HB GLN 60 -7.298 -8.523 -0.459
503 2HB GLN 60 1HB GLN 60 -5.904 -8.722 -1.508
504 1HG GLN 60 2HG GLN 60 -7.321 -9.923 -3.120
505 2HG GLN 60 1HG GLN 60 -8.715 -9.638 -2.078
506 1HE2 GLN 60 1HE2 GLN 60 -8.197 -8.774 -4.821
507 2HE2 GLN 60 2HE2 GLN 60 -8.328 -7.053 -4.813
508 H GLN 61 H GLN 61 -4.107 -10.644 -1.193
509 HA GLN 61 HA GLN 61 -4.405 -12.131 -3.611
510 1HB GLN 61 2HB GLN 61 -2.639 -10.467 -3.340
511 2HB GLN 61 1HB GLN 61 -1.933 -11.403 -2.031
512 1HG GLN 61 2HG GLN 61 -1.379 -13.191 -3.556
513 2HG GLN 61 1HG GLN 61 -2.191 -12.352 -4.875
514 1HE2 GLN 61 1HE2 GLN 61 -0.350 -12.313 -6.120
515 2HE2 GLN 61 2HE2 GLN 61 0.992 -11.270 -5.774
516 H LYS 62 H LYS 62 -3.395 -12.924 -0.321
517 HA LYS 62 HA LYS 62 -3.005 -15.704 -1.162
518 1HB LYS 62 2HB LYS 62 -1.165 -14.641 0.114
519 2HB LYS 62 1HB LYS 62 -2.266 -14.393 1.463
520 1HG LYS 62 2HG LYS 62 -2.507 -16.761 1.778
521 2HG LYS 62 1HG LYS 62 -1.562 -17.087 0.324
522 1HD LYS 62 2HD LYS 62 0.390 -16.021 1.382
523 2HD LYS 62 1HD LYS 62 -0.564 -15.757 2.843
524 1HE LYS 62 2HE LYS 62 0.839 -17.733 3.071
525 2HE LYS 62 1HE LYS 62 -0.870 -18.170 3.084
526 1HZ LYS 62 1HZ LYS 62 0.311 -19.706 1.713
527 2HZ LYS 62 2HZ LYS 62 1.026 -18.460 0.815
528 3HZ LYS 62 3HZ LYS 62 -0.643 -18.739 0.699
Start of MODEL 13
1 1H MET 1 1HT MET 1 -13.799 18.184 -5.004
2 2H MET 1 2HT MET 1 -14.180 17.390 -3.558
3 3H MET 1 3HT MET 1 -14.164 16.526 -5.019
4 HA MET 1 HA MET 1 -11.829 17.757 -3.670
5 1HB MET 1 2HB MET 1 -12.572 14.859 -4.155
6 2HB MET 1 1HB MET 1 -11.054 15.410 -3.463
7 1HG MET 1 2HG MET 1 -12.225 16.316 -1.546
8 2HG MET 1 1HG MET 1 -13.773 15.856 -2.250
9 1HE MET 1 1HE MET 1 -13.532 11.938 -2.204
10 2HE MET 1 2HE MET 1 -13.042 13.009 -3.517
11 3HE MET 1 3HE MET 1 -14.529 13.331 -2.625
12 H GLY 2 H GLY 2 -10.164 18.227 -4.970
13 1HA GLY 2 2HA GLY 2 -10.306 17.428 -7.774
14 2HA GLY 2 1HA GLY 2 -9.197 18.605 -7.077
15 H ASN 3 H ASN 3 -9.725 15.286 -7.871
16 HA ASN 3 HA ASN 3 -6.918 14.708 -7.393
17 1HB ASN 3 2HB ASN 3 -8.405 14.150 -5.305
18 2HB ASN 3 1HB ASN 3 -8.918 12.768 -6.266
19 1HD2 ASN 3 1HD2 ASN 3 -6.301 14.261 -4.559
20 2HD2 ASN 3 2HD2 ASN 3 -5.248 12.892 -4.555
21 H ILE 4 H ILE 4 -7.223 11.866 -7.733
22 HA ILE 4 HA ILE 4 -8.391 11.722 -10.429
23 HB ILE 4 HB ILE 4 -5.880 12.072 -10.454
24 1HG1 ILE 4 2HG1 ILE 4 -5.442 10.366 -12.168
25 2HG1 ILE 4 1HG1 ILE 4 -6.868 9.472 -11.651
26 1HG2 ILE 4 1HG2 ILE 4 -5.865 9.301 -9.277
27 2HG2 ILE 4 2HG2 ILE 4 -5.282 10.779 -8.514
28 3HG2 ILE 4 3HG2 ILE 4 -4.458 10.138 -9.934
29 1HD1 ILE 4 1HD1 ILE 4 -7.295 10.748 -13.674
30 2HD1 ILE 4 2HD1 ILE 4 -6.855 12.238 -12.837
31 3HD1 ILE 4 3HD1 ILE 4 -8.282 11.332 -12.335
32 H ARG 5 H ARG 5 -7.826 9.060 -10.955
33 HA ARG 5 HA ARG 5 -9.746 7.596 -9.642
34 1HB ARG 5 2HB ARG 5 -8.551 5.578 -10.500
35 2HB ARG 5 1HB ARG 5 -8.829 6.815 -11.722
36 1HG ARG 5 2HG ARG 5 -6.518 7.555 -11.524
37 2HG ARG 5 1HG ARG 5 -6.234 6.364 -10.253
38 1HD ARG 5 2HD ARG 5 -5.412 5.662 -12.493
39 2HD ARG 5 1HD ARG 5 -6.586 4.554 -11.784
40 HE ARG 5 HE ARG 5 -8.179 5.253 -13.357
41 1HH1 ARG 5 1HH1 ARG 5 -5.060 6.776 -13.847
42 2HH1 ARG 5 2HH1 ARG 5 -5.440 7.324 -15.450
43 1HH2 ARG 5 1HH2 ARG 5 -8.662 5.966 -15.473
44 2HH2 ARG 5 2HH2 ARG 5 -7.467 6.845 -16.375
45 H THR 6 H THR 6 -9.884 6.485 -7.788
46 HA THR 6 HA THR 6 -7.977 6.895 -5.738
47 HB THR 6 HB THR 6 -10.120 4.774 -5.695
48 HG1 THR 6 1HG THR 6 -10.386 7.599 -5.365
49 1HG2 THR 6 1HG2 THR 6 -10.243 5.378 -3.319
50 2HG2 THR 6 2HG2 THR 6 -8.984 6.590 -3.559
51 3HG2 THR 6 3HG2 THR 6 -8.611 4.879 -3.764
52 H SER 7 H SER 7 -8.414 4.439 -8.130
53 HA SER 7 HA SER 7 -6.946 2.353 -6.918
54 1HB SER 7 2HB SER 7 -7.385 2.914 -9.860
55 2HB SER 7 1HB SER 7 -6.864 1.379 -9.164
56 HG SER 7 HG SER 7 -9.243 1.819 -9.658
57 H PHE 8 H PHE 8 -5.922 5.349 -8.083
58 HA PHE 8 HA PHE 8 -3.357 4.670 -9.074
59 1HB PHE 8 2HB PHE 8 -4.400 6.895 -9.411
60 2HB PHE 8 1HB PHE 8 -4.230 7.218 -7.689
61 HD1 PHE 8 1HD PHE 8 -2.352 8.319 -6.924
62 HD2 PHE 8 2HD PHE 8 -2.204 6.313 -10.677
63 HE1 PHE 8 1HE PHE 8 -0.100 9.225 -7.315
64 HE2 PHE 8 2HE PHE 8 0.048 7.217 -11.075
65 HZ PHE 8 HZ PHE 8 1.105 8.675 -9.393
66 H VAL 9 H VAL 9 -4.642 5.314 -5.865
67 HA VAL 9 HA VAL 9 -2.186 5.201 -4.457
68 HB VAL 9 HB VAL 9 -4.938 4.459 -3.437
69 1HG1 VAL 9 1HG1 VAL 9 -4.043 5.039 -1.233
70 2HG1 VAL 9 2HG1 VAL 9 -2.467 5.358 -1.956
71 3HG1 VAL 9 3HG1 VAL 9 -3.127 3.723 -1.969
72 1HG2 VAL 9 1HG2 VAL 9 -3.551 7.135 -3.468
73 2HG2 VAL 9 2HG2 VAL 9 -5.069 6.783 -2.642
74 3HG2 VAL 9 3HG2 VAL 9 -4.977 6.683 -4.401
75 H LYS 10 H LYS 10 -4.542 2.800 -5.457
76 HA LYS 10 HA LYS 10 -3.415 0.556 -4.170
77 1HB LYS 10 2HB LYS 10 -5.681 0.565 -5.099
78 2HB LYS 10 1HB LYS 10 -5.028 0.744 -6.721
79 1HG LYS 10 2HG LYS 10 -3.900 -1.461 -6.437
80 2HG LYS 10 1HG LYS 10 -4.764 -1.640 -4.906
81 1HD LYS 10 2HD LYS 10 -6.896 -1.453 -6.087
82 2HD LYS 10 1HD LYS 10 -6.039 -1.257 -7.616
83 1HE LYS 10 2HE LYS 10 -5.966 -3.682 -5.826
84 2HE LYS 10 1HE LYS 10 -6.838 -3.543 -7.349
85 1HZ LYS 10 1HZ LYS 10 -3.912 -3.629 -6.918
86 2HZ LYS 10 2HZ LYS 10 -4.585 -3.080 -8.374
87 3HZ LYS 10 3HZ LYS 10 -4.873 -4.669 -7.852
88 H ARG 11 H ARG 11 -2.726 2.177 -7.210
89 HA ARG 11 HA ARG 11 -0.977 0.148 -8.203
90 1HB ARG 11 2HB ARG 11 -2.186 2.126 -9.460
91 2HB ARG 11 1HB ARG 11 -0.720 3.007 -9.053
92 1HG ARG 11 2HG ARG 11 0.099 0.529 -10.103
93 2HG ARG 11 1HG ARG 11 -1.178 1.132 -11.159
94 1HD ARG 11 2HD ARG 11 0.834 1.988 -12.032
95 2HD ARG 11 1HD ARG 11 0.070 3.332 -11.184
96 HE ARG 11 HE ARG 11 1.721 2.264 -9.313
97 1HH1 ARG 11 1HH1 ARG 11 2.202 3.326 -12.607
98 2HH1 ARG 11 2HH1 ARG 11 3.839 3.828 -12.350
99 1HH2 ARG 11 1HH2 ARG 11 3.910 2.910 -8.976
100 2HH2 ARG 11 2HH2 ARG 11 4.812 3.581 -10.299
101 H ILE 12 H ILE 12 -0.637 2.949 -6.145
102 HA ILE 12 HA ILE 12 2.214 2.933 -6.041
103 HB ILE 12 HB ILE 12 0.229 3.953 -3.995
104 1HG1 ILE 12 2HG1 ILE 12 1.755 5.426 -6.157
105 2HG1 ILE 12 1HG1 ILE 12 0.042 5.027 -6.218
106 1HG2 ILE 12 1HG2 ILE 12 3.187 4.469 -4.280
107 2HG2 ILE 12 2HG2 ILE 12 2.398 3.578 -2.979
108 3HG2 ILE 12 3HG2 ILE 12 2.112 5.309 -3.160
109 1HD1 ILE 12 1HD1 ILE 12 1.357 6.844 -4.212
110 2HD1 ILE 12 2HD1 ILE 12 -0.360 6.449 -4.282
111 3HD1 ILE 12 3HD1 ILE 12 0.390 7.348 -5.601
112 H ALA 13 H ALA 13 -0.362 1.406 -4.170
113 HA ALA 13 HA ALA 13 1.274 0.093 -2.290
114 1HB ALA 13 1HB ALA 13 -1.126 0.319 -1.974
115 2HB ALA 13 2HB ALA 13 -0.653 -1.379 -1.923
116 3HB ALA 13 3HB ALA 13 -1.422 -0.721 -3.368
117 H LYS 14 H LYS 14 0.132 -0.841 -5.515
118 HA LYS 14 HA LYS 14 1.298 -3.402 -5.576
119 1HB LYS 14 2HB LYS 14 -0.308 -2.683 -7.282
120 2HB LYS 14 1HB LYS 14 0.831 -1.476 -7.867
121 1HG LYS 14 2HG LYS 14 2.404 -3.320 -8.420
122 2HG LYS 14 1HG LYS 14 1.142 -4.470 -7.981
123 1HD LYS 14 2HD LYS 14 -0.293 -3.600 -9.738
124 2HD LYS 14 1HD LYS 14 0.912 -2.372 -10.142
125 1HE LYS 14 2HE LYS 14 2.516 -4.193 -10.658
126 2HE LYS 14 1HE LYS 14 1.231 -5.363 -10.373
127 1HZ LYS 14 1HZ LYS 14 0.000 -4.457 -12.214
128 2HZ LYS 14 2HZ LYS 14 1.565 -4.853 -12.731
129 3HZ LYS 14 3HZ LYS 14 1.153 -3.233 -12.441
130 H GLU 15 H GLU 15 2.552 -0.221 -6.465
131 HA GLU 15 HA GLU 15 5.063 -0.933 -7.416
132 1HB GLU 15 2HB GLU 15 4.152 1.346 -7.528
133 2HB GLU 15 1HB GLU 15 4.274 1.487 -5.780
134 1HG GLU 15 2HG GLU 15 6.731 1.238 -5.982
135 2HG GLU 15 1HG GLU 15 6.547 1.245 -7.738
136 H MET 16 H MET 16 4.016 -0.255 -4.108
137 HA MET 16 HA MET 16 6.410 -0.591 -2.749
138 1HB MET 16 2HB MET 16 4.398 0.250 -1.675
139 2HB MET 16 1HB MET 16 3.595 -1.297 -1.902
140 1HG MET 16 2HG MET 16 4.240 -1.204 0.356
141 2HG MET 16 1HG MET 16 5.358 -2.313 -0.433
142 1HE MET 16 1HE MET 16 4.850 1.248 1.105
143 2HE MET 16 2HE MET 16 5.301 1.624 -0.559
144 3HE MET 16 3HE MET 16 6.400 2.017 0.765
145 H ILE 17 H ILE 17 3.939 -3.040 -3.498
146 HA ILE 17 HA ILE 17 5.388 -5.127 -2.185
147 HB ILE 17 HB ILE 17 3.000 -5.303 -4.027
148 1HG1 ILE 17 2HG1 ILE 17 3.138 -5.319 -1.000
149 2HG1 ILE 17 1HG1 ILE 17 2.663 -3.928 -1.973
150 1HG2 ILE 17 1HG2 ILE 17 2.635 -7.509 -3.042
151 2HG2 ILE 17 2HG2 ILE 17 4.117 -7.339 -2.100
152 3HG2 ILE 17 3HG2 ILE 17 4.197 -7.429 -3.861
153 1HD1 ILE 17 1HD1 ILE 17 0.764 -5.221 -2.833
154 2HD1 ILE 17 2HD1 ILE 17 0.722 -5.036 -1.080
155 3HD1 ILE 17 3HD1 ILE 17 1.229 -6.567 -1.794
156 H GLU 18 H GLU 18 4.725 -4.377 -5.611
157 HA GLU 18 HA GLU 18 5.920 -6.752 -6.586
158 1HB GLU 18 2HB GLU 18 4.246 -5.355 -7.824
159 2HB GLU 18 1HB GLU 18 5.523 -4.183 -8.123
160 1HG GLU 18 2HG GLU 18 6.804 -5.889 -9.318
161 2HG GLU 18 1HG GLU 18 5.513 -7.053 -9.032
162 H THR 19 H THR 19 7.225 -3.554 -5.915
163 HA THR 19 HA THR 19 9.737 -4.166 -7.216
164 HB THR 19 HB THR 19 9.207 -1.836 -5.372
165 HG1 THR 19 1HG THR 19 7.706 -1.380 -6.817
166 1HG2 THR 19 1HG2 THR 19 11.534 -2.180 -6.026
167 2HG2 THR 19 2HG2 THR 19 10.881 -0.725 -6.783
168 3HG2 THR 19 3HG2 THR 19 11.064 -2.206 -7.726
169 H HIS 20 H HIS 20 8.304 -4.696 -4.193
170 HA HIS 20 HA HIS 20 10.901 -5.449 -3.034
171 1HB HIS 20 2HB HIS 20 9.910 -3.241 -2.151
172 2HB HIS 20 1HB HIS 20 8.675 -4.239 -1.398
173 HD1 HIS 20 1HD HIS 20 9.515 -5.896 0.499
174 HD2 HIS 20 2HD HIS 20 12.299 -3.119 -0.839
175 HE1 HIS 20 1HE HIS 20 11.304 -5.829 2.263
176 HE2 HIS 20 2HE HIS 20 12.843 -3.966 1.538
177 HA PRO 21 HA PRO 21 7.633 -8.780 -2.922
178 1HB PRO 21 2HB PRO 21 9.568 -10.540 -4.175
179 2HB PRO 21 1HB PRO 21 8.006 -10.001 -4.790
180 1HG PRO 21 2HG PRO 21 10.373 -9.223 -5.878
181 2HG PRO 21 1HG PRO 21 8.912 -8.218 -5.913
182 1HD PRO 21 2HD PRO 21 11.278 -8.058 -4.078
183 2HD PRO 21 1HD PRO 21 10.382 -6.747 -4.879
184 H GLY 22 H GLY 22 10.593 -8.286 -1.523
185 1HA GLY 22 2HA GLY 22 10.553 -10.812 -0.041
186 2HA GLY 22 1HA GLY 22 11.826 -9.597 0.016
187 H LYS 23 H LYS 23 10.206 -10.931 2.130
188 HA LYS 23 HA LYS 23 9.585 -10.364 4.247
189 1HB LYS 23 2HB LYS 23 10.034 -7.483 3.433
190 2HB LYS 23 1HB LYS 23 9.853 -8.085 5.074
191 1HG LYS 23 2HG LYS 23 11.936 -9.354 4.825
192 2HG LYS 23 1HG LYS 23 12.116 -8.710 3.191
193 1HD LYS 23 2HD LYS 23 12.104 -6.416 4.157
194 2HD LYS 23 1HD LYS 23 12.099 -7.140 5.767
195 1HE LYS 23 2HE LYS 23 14.215 -8.305 5.187
196 2HE LYS 23 1HE LYS 23 14.228 -7.436 3.653
197 1HZ LYS 23 1HZ LYS 23 14.337 -6.199 6.356
198 2HZ LYS 23 2HZ LYS 23 14.314 -5.346 4.894
199 3HZ LYS 23 3HZ LYS 23 15.633 -6.344 5.272
200 H PHE 24 H PHE 24 7.790 -10.335 1.805
201 HA PHE 24 HA PHE 24 5.735 -8.442 2.369
202 1HB PHE 24 2HB PHE 24 4.427 -9.545 0.672
203 2HB PHE 24 1HB PHE 24 6.086 -9.430 0.102
204 HD1 PHE 24 1HD PHE 24 7.537 -11.493 0.199
205 HD2 PHE 24 2HD PHE 24 3.332 -11.606 0.833
206 HE1 PHE 24 1HE PHE 24 7.534 -13.907 -0.266
207 HE2 PHE 24 2HE PHE 24 3.325 -14.021 0.370
208 HZ PHE 24 HZ PHE 24 5.427 -15.174 -0.181
209 H THR 25 H THR 25 4.325 -8.515 3.947
210 HA THR 25 HA THR 25 3.168 -11.024 4.806
211 HB THR 25 HB THR 25 4.593 -9.280 6.835
212 HG1 THR 25 1HG THR 25 5.552 -11.250 5.212
213 1HG2 THR 25 1HG2 THR 25 2.682 -10.499 7.743
214 2HG2 THR 25 2HG2 THR 25 4.192 -11.176 8.356
215 3HG2 THR 25 3HG2 THR 25 3.307 -12.007 7.076
216 H ASP 26 H ASP 26 1.173 -10.735 5.805
217 HA ASP 26 HA ASP 26 -0.120 -8.195 5.384
218 1HB ASP 26 2HB ASP 26 -2.133 -9.392 6.186
219 2HB ASP 26 1HB ASP 26 -1.303 -10.285 4.918
220 H ASP 27 H ASP 27 1.911 -7.835 7.141
221 HA ASP 27 HA ASP 27 0.802 -7.924 9.858
222 1HB ASP 27 2HB ASP 27 2.888 -9.116 9.593
223 2HB ASP 27 1HB ASP 27 3.638 -7.720 8.829
224 H PHE 28 H PHE 28 0.692 -6.085 11.119
225 HA PHE 28 HA PHE 28 0.287 -3.664 9.658
226 1HB PHE 28 2HB PHE 28 0.191 -4.223 12.629
227 2HB PHE 28 1HB PHE 28 -0.312 -2.712 11.878
228 HD1 PHE 28 1HD PHE 28 -2.285 -2.669 10.392
229 HD2 PHE 28 2HD PHE 28 -1.199 -6.151 12.590
230 HE1 PHE 28 1HE PHE 28 -4.535 -3.598 10.030
231 HE2 PHE 28 2HE PHE 28 -3.448 -7.081 12.232
232 HZ PHE 28 HZ PHE 28 -5.115 -5.804 10.948
233 H ASP 29 H ASP 29 2.721 -4.739 12.007
234 HA ASP 29 HA ASP 29 4.115 -2.284 12.146
235 1HB ASP 29 2HB ASP 29 4.580 -3.889 13.827
236 2HB ASP 29 1HB ASP 29 4.940 -5.137 12.642
237 H THR 30 H THR 30 4.334 -5.048 10.000
238 HA THR 30 HA THR 30 6.639 -4.302 8.580
239 HB THR 30 HB THR 30 4.263 -5.891 7.595
240 HG1 THR 30 1HG THR 30 5.304 -6.705 9.521
241 1HG2 THR 30 1HG2 THR 30 5.722 -5.144 5.766
242 2HG2 THR 30 2HG2 THR 30 5.846 -6.885 6.013
243 3HG2 THR 30 3HG2 THR 30 7.119 -5.818 6.607
244 H ASN 31 H ASN 31 3.192 -3.802 7.721
245 HA ASN 31 HA ASN 31 3.722 -2.425 5.332
246 1HB ASN 31 2HB ASN 31 1.387 -1.764 5.339
247 2HB ASN 31 1HB ASN 31 1.527 -3.436 5.850
248 1HD2 ASN 31 1HD2 ASN 31 -0.117 -3.773 7.162
249 2HD2 ASN 31 2HD2 ASN 31 -0.548 -2.797 8.517
250 H LYS 32 H LYS 32 3.600 -1.346 8.629
251 HA LYS 32 HA LYS 32 3.344 1.424 8.143
252 1HB LYS 32 2HB LYS 32 2.995 0.170 10.333
253 2HB LYS 32 1HB LYS 32 4.743 0.138 10.490
254 1HG LYS 32 2HG LYS 32 3.355 2.746 10.093
255 2HG LYS 32 1HG LYS 32 3.332 1.973 11.677
256 1HD LYS 32 2HD LYS 32 5.824 1.869 11.584
257 2HD LYS 32 1HD LYS 32 5.758 2.814 10.094
258 1HE LYS 32 2HE LYS 32 4.651 4.626 11.278
259 2HE LYS 32 1HE LYS 32 4.651 3.678 12.762
260 1HZ LYS 32 1HZ LYS 32 6.436 5.208 12.874
261 2HZ LYS 32 2HZ LYS 32 7.011 4.782 11.337
262 3HZ LYS 32 3HZ LYS 32 7.123 3.678 12.620
263 H LYS 33 H LYS 33 6.176 -0.626 8.781
264 HA LYS 33 HA LYS 33 8.054 1.484 8.591
265 1HB LYS 33 2HB LYS 33 8.421 -1.503 8.361
266 2HB LYS 33 1HB LYS 33 9.741 -0.348 8.471
267 1HG LYS 33 2HG LYS 33 8.996 0.338 10.670
268 2HG LYS 33 1HG LYS 33 7.609 -0.745 10.556
269 1HD LYS 33 2HD LYS 33 10.500 -1.604 10.511
270 2HD LYS 33 1HD LYS 33 9.428 -1.702 11.910
271 1HE LYS 33 2HE LYS 33 7.916 -3.152 10.542
272 2HE LYS 33 1HE LYS 33 9.158 -3.169 9.290
273 1HZ LYS 33 1HZ LYS 33 9.266 -5.121 10.730
274 2HZ LYS 33 2HZ LYS 33 9.525 -4.125 12.076
275 3HZ LYS 33 3HZ LYS 33 10.682 -4.196 10.837
276 H LEU 34 H LEU 34 6.571 -0.570 6.205
277 HA LEU 34 HA LEU 34 8.520 -0.177 4.167
278 1HB LEU 34 2HB LEU 34 5.593 -0.909 3.991
279 2HB LEU 34 1HB LEU 34 6.693 -0.916 2.625
280 HG LEU 34 HG LEU 34 6.939 -2.660 5.079
281 1HD1 LEU 34 1HD1 LEU 34 6.315 -4.483 3.594
282 2HD1 LEU 34 2HD1 LEU 34 6.109 -3.344 2.262
283 3HD1 LEU 34 3HD1 LEU 34 5.040 -3.268 3.664
284 1HD2 LEU 34 1HD2 LEU 34 8.700 -3.802 3.834
285 2HD2 LEU 34 2HD2 LEU 34 9.111 -2.106 4.091
286 3HD2 LEU 34 3HD2 LEU 34 8.532 -2.644 2.514
287 H VAL 35 H VAL 35 5.401 1.401 4.866
288 HA VAL 35 HA VAL 35 5.604 3.237 2.706
289 HB VAL 35 HB VAL 35 4.011 3.654 5.241
290 1HG1 VAL 35 1HG1 VAL 35 3.590 4.631 2.422
291 2HG1 VAL 35 2HG1 VAL 35 4.168 5.600 3.777
292 3HG1 VAL 35 3HG1 VAL 35 2.530 4.947 3.794
293 1HG2 VAL 35 1HG2 VAL 35 3.512 1.443 4.350
294 2HG2 VAL 35 2HG2 VAL 35 3.230 2.138 2.754
295 3HG2 VAL 35 3HG2 VAL 35 2.154 2.539 4.092
296 H GLU 36 H GLU 36 6.881 3.152 5.915
297 HA GLU 36 HA GLU 36 7.545 5.817 6.366
298 1HB GLU 36 2HB GLU 36 8.984 3.268 7.108
299 2HB GLU 36 1HB GLU 36 9.500 4.853 7.668
300 1HG GLU 36 2HG GLU 36 6.745 3.770 8.155
301 2HG GLU 36 1HG GLU 36 8.097 3.492 9.251
302 H GLU 37 H GLU 37 9.132 3.381 4.361
303 HA GLU 37 HA GLU 37 10.715 5.394 3.056
304 1HB GLU 37 2HB GLU 37 11.894 4.778 5.261
305 2HB GLU 37 1HB GLU 37 12.248 3.242 4.495
306 1HG GLU 37 2HG GLU 37 12.976 5.743 3.062
307 2HG GLU 37 1HG GLU 37 13.962 5.225 4.428
308 H PHE 38 H PHE 38 9.608 4.595 1.274
309 HA PHE 38 HA PHE 38 11.185 2.878 -0.283
310 1HB PHE 38 2HB PHE 38 9.964 1.125 1.066
311 2HB PHE 38 1HB PHE 38 8.466 1.694 0.336
312 HD1 PHE 38 1HD PHE 38 11.680 0.041 -0.307
313 HD2 PHE 38 2HD PHE 38 7.894 1.130 -1.914
314 HE1 PHE 38 1HE PHE 38 12.075 -1.438 -2.233
315 HE2 PHE 38 2HE PHE 38 8.282 -0.347 -3.840
316 HZ PHE 38 HZ PHE 38 10.373 -1.634 -4.003
317 H SER 39 H SER 39 7.655 3.094 -0.408
318 HA SER 39 HA SER 39 7.887 4.879 -2.722
319 1HB SER 39 2HB SER 39 5.555 3.214 -1.741
320 2HB SER 39 1HB SER 39 5.522 4.248 -3.169
321 HG SER 39 HG SER 39 6.703 2.845 -4.245
322 H THR 40 H THR 40 8.482 6.177 -0.526
323 HA THR 40 HA THR 40 6.210 7.176 0.909
324 HB THR 40 HB THR 40 9.030 8.268 0.934
325 HG1 THR 40 1HG THR 40 8.158 6.411 2.847
326 1HG2 THR 40 1HG2 THR 40 6.843 8.239 3.022
327 2HG2 THR 40 2HG2 THR 40 7.344 9.640 2.077
328 3HG2 THR 40 3HG2 THR 40 8.461 8.910 3.231
329 H VAL 41 H VAL 41 4.877 8.597 0.060
330 HA VAL 41 HA VAL 41 5.939 10.770 -1.631
331 HB VAL 41 HB VAL 41 3.305 9.326 -2.047
332 1HG1 VAL 41 1HG1 VAL 41 3.177 11.676 -2.650
333 2HG1 VAL 41 2HG1 VAL 41 3.150 10.668 -4.096
334 3HG1 VAL 41 3HG1 VAL 41 4.626 11.518 -3.643
335 1HG2 VAL 41 1HG2 VAL 41 5.224 7.946 -2.712
336 2HG2 VAL 41 2HG2 VAL 41 5.806 9.259 -3.734
337 3HG2 VAL 41 3HG2 VAL 41 4.277 8.463 -4.109
338 H SER 42 H SER 42 5.871 12.363 -0.058
339 HA SER 42 HA SER 42 5.016 13.866 1.447
340 1HB SER 42 2HB SER 42 2.469 13.354 -0.121
341 2HB SER 42 1HB SER 42 2.768 14.739 0.929
342 HG SER 42 HG SER 42 3.398 15.571 -0.916
343 H THR 43 H THR 43 5.133 11.222 2.327
344 HA THR 43 HA THR 43 2.540 10.423 3.303
345 HB THR 43 HB THR 43 5.207 9.034 3.551
346 HG1 THR 43 1HG THR 43 3.381 9.309 1.493
347 1HG2 THR 43 1HG2 THR 43 2.391 7.991 3.876
348 2HG2 THR 43 2HG2 THR 43 3.529 8.288 5.188
349 3HG2 THR 43 3HG2 THR 43 3.874 7.040 3.991
350 H LYS 44 H LYS 44 2.184 12.046 4.886
351 HA LYS 44 HA LYS 44 3.627 11.500 7.382
352 1HB LYS 44 2HB LYS 44 3.320 13.898 6.736
353 2HB LYS 44 1HB LYS 44 1.579 13.667 6.853
354 1HG LYS 44 2HG LYS 44 1.820 13.089 9.216
355 2HG LYS 44 1HG LYS 44 3.561 13.329 9.092
356 1HD LYS 44 2HD LYS 44 3.195 15.674 8.496
357 2HD LYS 44 1HD LYS 44 1.449 15.433 8.637
358 1HE LYS 44 2HE LYS 44 1.781 14.770 11.001
359 2HE LYS 44 1HE LYS 44 3.495 15.142 10.832
360 1HZ LYS 44 1HZ LYS 44 2.937 17.436 10.378
361 2HZ LYS 44 2HZ LYS 44 2.249 16.952 11.854
362 3HZ LYS 44 3HZ LYS 44 1.279 17.085 10.470
363 H HIS 45 H HIS 45 0.256 12.173 6.434
364 HA HIS 45 HA HIS 45 -0.646 10.186 8.394
365 1HB HIS 45 2HB HIS 45 -1.630 12.501 8.403
366 2HB HIS 45 1HB HIS 45 -2.318 12.161 6.821
367 HD1 HIS 45 1HD HIS 45 -2.766 11.476 10.448
368 HD2 HIS 45 2HD HIS 45 -4.501 10.345 6.835
369 HE1 HIS 45 1HE HIS 45 -4.952 10.376 11.051
370 HE2 HIS 45 2HE HIS 45 -5.892 9.537 8.868
371 H LEU 46 H LEU 46 -0.240 10.673 5.031
372 HA LEU 46 HA LEU 46 -2.220 8.941 4.002
373 1HB LEU 46 2HB LEU 46 -0.923 10.598 2.681
374 2HB LEU 46 1HB LEU 46 0.499 9.590 2.854
375 HG LEU 46 HG LEU 46 -0.662 7.790 1.602
376 1HD1 LEU 46 1HD1 LEU 46 -2.786 9.889 1.191
377 2HD1 LEU 46 2HD1 LEU 46 -2.960 8.404 2.128
378 3HD1 LEU 46 3HD1 LEU 46 -2.709 8.324 0.383
379 1HD2 LEU 46 1HD2 LEU 46 -0.527 8.885 -0.592
380 2HD2 LEU 46 2HD2 LEU 46 0.836 9.310 0.443
381 3HD2 LEU 46 3HD2 LEU 46 -0.484 10.458 0.205
382 H ARG 47 H ARG 47 0.549 8.343 5.799
383 HA ARG 47 HA ARG 47 1.645 5.985 4.930
384 1HB ARG 47 2HB ARG 47 2.566 7.176 6.803
385 2HB ARG 47 1HB ARG 47 1.097 6.951 7.739
386 1HG ARG 47 2HG ARG 47 1.562 4.472 7.648
387 2HG ARG 47 1HG ARG 47 3.147 4.883 6.990
388 1HD ARG 47 2HD ARG 47 2.056 5.891 9.614
389 2HD ARG 47 1HD ARG 47 3.161 4.529 9.443
390 HE ARG 47 HE ARG 47 4.800 6.131 8.528
391 1HH1 ARG 47 1HH1 ARG 47 2.120 7.420 10.402
392 2HH1 ARG 47 2HH1 ARG 47 2.997 8.834 10.904
393 1HH2 ARG 47 1HH2 ARG 47 5.933 7.959 9.188
394 2HH2 ARG 47 2HH2 ARG 47 5.164 9.143 10.206
395 H ASN 48 H ASN 48 -1.063 6.287 7.227
396 HA ASN 48 HA ASN 48 -1.388 3.478 7.494
397 1HB ASN 48 2HB ASN 48 -3.296 5.701 8.246
398 2HB ASN 48 1HB ASN 48 -3.369 4.037 8.822
399 1HD2 ASN 48 1HD2 ASN 48 -1.889 3.334 10.355
400 2HD2 ASN 48 2HD2 ASN 48 -0.875 4.424 11.236
401 H LYS 49 H LYS 49 -2.518 5.728 5.180
402 HA LYS 49 HA LYS 49 -4.845 4.260 4.376
403 1HB LYS 49 2HB LYS 49 -3.263 6.380 2.903
404 2HB LYS 49 1HB LYS 49 -4.822 5.743 2.394
405 1HG LYS 49 2HG LYS 49 -4.265 7.304 4.910
406 2HG LYS 49 1HG LYS 49 -5.106 7.884 3.471
407 1HD LYS 49 2HD LYS 49 -6.831 6.138 3.833
408 2HD LYS 49 1HD LYS 49 -6.014 5.687 5.330
409 1HE LYS 49 2HE LYS 49 -6.352 7.978 6.173
410 2HE LYS 49 1HE LYS 49 -7.231 8.373 4.699
411 1HZ LYS 49 1HZ LYS 49 -8.012 6.413 6.788
412 2HZ LYS 49 2HZ LYS 49 -8.792 6.543 5.288
413 3HZ LYS 49 3HZ LYS 49 -8.814 7.850 6.369
414 H ILE 50 H ILE 50 -1.622 4.759 2.949
415 HA ILE 50 HA ILE 50 -1.915 2.838 0.899
416 HB ILE 50 HB ILE 50 0.647 3.797 2.194
417 1HG1 ILE 50 2HG1 ILE 50 -0.813 4.864 -0.236
418 2HG1 ILE 50 1HG1 ILE 50 -0.755 5.648 1.339
419 1HG2 ILE 50 1HG2 ILE 50 1.720 3.151 0.101
420 2HG2 ILE 50 2HG2 ILE 50 0.175 2.569 -0.523
421 3HG2 ILE 50 3HG2 ILE 50 0.929 1.765 0.854
422 1HD1 ILE 50 1HD1 ILE 50 1.670 5.888 1.114
423 2HD1 ILE 50 2HD1 ILE 50 0.798 6.686 -0.194
424 3HD1 ILE 50 3HD1 ILE 50 1.587 5.135 -0.479
425 H ALA 51 H ALA 51 -0.571 2.697 4.161
426 HA ALA 51 HA ALA 51 0.420 0.084 4.124
427 1HB ALA 51 1HB ALA 51 0.308 0.186 6.551
428 2HB ALA 51 2HB ALA 51 -0.764 1.583 6.459
429 3HB ALA 51 3HB ALA 51 0.903 1.710 5.895
430 H GLY 52 H GLY 52 -2.826 1.309 4.815
431 1HA GLY 52 2HA GLY 52 -4.012 -1.085 5.660
432 2HA GLY 52 1HA GLY 52 -4.857 0.247 4.881
433 H TYR 53 H TYR 53 -3.676 0.294 2.408
434 HA TYR 53 HA TYR 53 -4.974 -1.770 1.026
435 1HB TYR 53 2HB TYR 53 -3.018 0.350 0.276
436 2HB TYR 53 1HB TYR 53 -3.278 -0.975 -0.857
437 HD1 TYR 53 1HD TYR 53 -5.479 -1.319 -1.880
438 HD2 TYR 53 2HD TYR 53 -4.722 2.018 0.652
439 HE1 TYR 53 1HE TYR 53 -7.513 -0.230 -2.719
440 HE2 TYR 53 2HE TYR 53 -6.759 3.121 -0.185
441 HH TYR 53 HH TYR 53 -9.144 1.501 -1.864
442 H ILE 54 H ILE 54 -1.513 -1.324 1.732
443 HA ILE 54 HA ILE 54 -0.440 -3.515 0.460
444 HB ILE 54 HB ILE 54 0.349 -2.497 3.195
445 1HG1 ILE 54 2HG1 ILE 54 1.448 -1.752 0.476
446 2HG1 ILE 54 1HG1 ILE 54 0.321 -0.763 1.399
447 1HG2 ILE 54 1HG2 ILE 54 1.936 -4.090 1.183
448 2HG2 ILE 54 2HG2 ILE 54 1.304 -4.692 2.715
449 3HG2 ILE 54 3HG2 ILE 54 2.550 -3.444 2.705
450 1HD1 ILE 54 1HD1 ILE 54 2.594 0.041 1.649
451 2HD1 ILE 54 2HD1 ILE 54 3.102 -1.538 2.247
452 3HD1 ILE 54 3HD1 ILE 54 1.974 -0.561 3.188
453 H THR 55 H THR 55 -1.474 -3.458 3.867
454 HA THR 55 HA THR 55 -1.163 -6.066 4.565
455 HB THR 55 HB THR 55 -3.658 -4.592 5.359
456 HG1 THR 55 1HG THR 55 -2.107 -3.016 5.548
457 1HG2 THR 55 1HG2 THR 55 -3.272 -6.833 6.291
458 2HG2 THR 55 2HG2 THR 55 -3.166 -5.589 7.539
459 3HG2 THR 55 3HG2 THR 55 -1.695 -6.310 6.883
460 H ARG 56 H ARG 56 -4.188 -4.725 3.172
461 HA ARG 56 HA ARG 56 -5.443 -7.282 3.235
462 1HB ARG 56 2HB ARG 56 -6.326 -4.773 1.807
463 2HB ARG 56 1HB ARG 56 -7.324 -6.192 2.112
464 1HG ARG 56 2HG ARG 56 -6.751 -5.774 4.594
465 2HG ARG 56 1HG ARG 56 -6.288 -4.163 4.047
466 1HD ARG 56 2HD ARG 56 -8.548 -3.931 3.027
467 2HD ARG 56 1HD ARG 56 -8.987 -5.474 3.760
468 HE ARG 56 HE ARG 56 -8.723 -2.918 5.079
469 1HH1 ARG 56 1HH1 ARG 56 -8.817 -6.401 5.522
470 2HH1 ARG 56 2HH1 ARG 56 -9.239 -6.295 7.207
471 1HH2 ARG 56 1HH2 ARG 56 -9.277 -2.785 7.275
472 2HH2 ARG 56 2HH2 ARG 56 -9.494 -4.238 8.208
473 H ILE 57 H ILE 57 -3.767 -5.470 0.723
474 HA ILE 57 HA ILE 57 -4.539 -7.131 -1.433
475 HB ILE 57 HB ILE 57 -2.066 -5.430 -1.071
476 1HG1 ILE 57 2HG1 ILE 57 -4.581 -4.995 -2.703
477 2HG1 ILE 57 1HG1 ILE 57 -4.238 -4.231 -1.156
478 1HG2 ILE 57 1HG2 ILE 57 -1.720 -5.659 -3.484
479 2HG2 ILE 57 2HG2 ILE 57 -3.056 -6.806 -3.567
480 3HG2 ILE 57 3HG2 ILE 57 -1.598 -7.216 -2.663
481 1HD1 ILE 57 1HD1 ILE 57 -2.314 -3.100 -2.144
482 2HD1 ILE 57 2HD1 ILE 57 -3.805 -2.720 -3.005
483 3HD1 ILE 57 3HD1 ILE 57 -2.658 -3.869 -3.693
484 H ILE 58 H ILE 58 -1.836 -7.262 0.852
485 HA ILE 58 HA ILE 58 -0.657 -9.602 -0.228
486 HB ILE 58 HB ILE 58 -0.518 -8.479 2.578
487 1HG1 ILE 58 2HG1 ILE 58 1.400 -8.316 0.243
488 2HG1 ILE 58 1HG1 ILE 58 0.388 -7.004 0.834
489 1HG2 ILE 58 1HG2 ILE 58 0.002 -10.857 2.598
490 2HG2 ILE 58 2HG2 ILE 58 1.453 -9.897 2.883
491 3HG2 ILE 58 3HG2 ILE 58 1.172 -10.625 1.299
492 1HD1 ILE 58 1HD1 ILE 58 2.673 -8.322 2.277
493 2HD1 ILE 58 2HD1 ILE 58 1.604 -7.117 2.991
494 3HD1 ILE 58 3HD1 ILE 58 2.623 -6.685 1.620
495 H SER 59 H SER 59 -3.257 -9.025 2.057
496 HA SER 59 HA SER 59 -3.578 -11.681 2.958
497 1HB SER 59 2HB SER 59 -5.677 -9.515 2.678
498 2HB SER 59 1HB SER 59 -5.814 -10.970 3.667
499 HG SER 59 HG SER 59 -3.535 -9.649 4.247
500 H GLN 60 H GLN 60 -4.434 -10.093 0.015
501 HA GLN 60 HA GLN 60 -6.395 -11.983 -0.857
502 1HB GLN 60 2HB GLN 60 -4.796 -9.898 -2.344
503 2HB GLN 60 1HB GLN 60 -6.048 -10.878 -3.088
504 1HG GLN 60 2HG GLN 60 -6.511 -9.062 -0.740
505 2HG GLN 60 1HG GLN 60 -6.761 -8.591 -2.419
506 1HE2 GLN 60 1HE2 GLN 60 -8.651 -8.765 -0.214
507 2HE2 GLN 60 2HE2 GLN 60 -9.897 -9.843 -0.739
508 H GLN 61 H GLN 61 -3.000 -11.385 -1.806
509 HA GLN 61 HA GLN 61 -2.973 -13.760 -3.448
510 1HB GLN 61 2HB GLN 61 -0.916 -11.680 -2.776
511 2HB GLN 61 1HB GLN 61 -0.463 -13.156 -3.611
512 1HG GLN 61 2HG GLN 61 -0.771 -11.491 -5.252
513 2HG GLN 61 1HG GLN 61 -2.153 -12.579 -5.361
514 1HE2 GLN 61 1HE2 GLN 61 -1.055 -9.419 -4.437
515 2HE2 GLN 61 2HE2 GLN 61 -2.614 -8.684 -4.336
516 H LYS 62 H LYS 62 -1.334 -12.700 -0.501
517 HA LYS 62 HA LYS 62 -0.074 -13.753 1.046
518 1HB LYS 62 2HB LYS 62 -2.375 -14.883 1.306
519 2HB LYS 62 1HB LYS 62 -1.654 -16.255 0.476
520 1HG LYS 62 2HG LYS 62 0.070 -16.377 2.230
521 2HG LYS 62 1HG LYS 62 -0.728 -15.050 3.075
522 1HD LYS 62 2HD LYS 62 -2.795 -16.450 3.159
523 2HD LYS 62 1HD LYS 62 -1.850 -17.787 2.498
524 1HE LYS 62 2HE LYS 62 -0.303 -17.547 4.442
525 2HE LYS 62 1HE LYS 62 -1.421 -16.365 5.120
526 1HZ LYS 62 1HZ LYS 62 -1.910 -19.245 4.622
527 2HZ LYS 62 2HZ LYS 62 -3.157 -18.152 4.968
528 3HZ LYS 62 3HZ LYS 62 -1.931 -18.429 6.109
Start of MODEL 14
1 1H MET 1 1HT MET 1 -14.141 14.294 -9.529
2 2H MET 1 2HT MET 1 -15.218 13.554 -10.608
3 3H MET 1 3HT MET 1 -14.648 15.120 -10.922
4 HA MET 1 HA MET 1 -13.542 13.537 -12.330
5 1HB MET 1 2HB MET 1 -12.334 15.552 -11.413
6 2HB MET 1 1HB MET 1 -11.664 14.517 -10.164
7 1HG MET 1 2HG MET 1 -11.271 13.944 -13.083
8 2HG MET 1 1HG MET 1 -10.215 15.032 -12.190
9 1HE MET 1 1HE MET 1 -9.965 13.702 -9.343
10 2HE MET 1 2HE MET 1 -8.594 14.305 -10.274
11 3HE MET 1 3HE MET 1 -8.545 12.685 -9.578
12 H GLY 2 H GLY 2 -12.796 12.935 -8.898
13 1HA GLY 2 2HA GLY 2 -11.955 10.217 -9.582
14 2HA GLY 2 1HA GLY 2 -11.749 11.012 -8.025
15 H ASN 3 H ASN 3 -13.919 9.232 -10.078
16 HA ASN 3 HA ASN 3 -16.137 9.266 -8.265
17 1HB ASN 3 2HB ASN 3 -15.545 7.316 -10.509
18 2HB ASN 3 1HB ASN 3 -17.097 7.539 -9.712
19 1HD2 ASN 3 1HD2 ASN 3 -16.374 7.782 -12.521
20 2HD2 ASN 3 2HD2 ASN 3 -16.815 9.384 -13.001
21 H ILE 4 H ILE 4 -14.714 8.742 -6.389
22 HA ILE 4 HA ILE 4 -13.982 7.360 -4.749
23 HB ILE 4 HB ILE 4 -15.255 5.123 -6.341
24 1HG1 ILE 4 2HG1 ILE 4 -16.314 6.683 -3.967
25 2HG1 ILE 4 1HG1 ILE 4 -16.855 6.881 -5.630
26 1HG2 ILE 4 1HG2 ILE 4 -15.167 3.845 -4.264
27 2HG2 ILE 4 2HG2 ILE 4 -14.364 5.195 -3.460
28 3HG2 ILE 4 3HG2 ILE 4 -13.549 4.336 -4.766
29 1HD1 ILE 4 1HD1 ILE 4 -17.119 4.379 -3.978
30 2HD1 ILE 4 2HD1 ILE 4 -17.677 4.587 -5.639
31 3HD1 ILE 4 3HD1 ILE 4 -18.408 5.528 -4.340
32 H ARG 5 H ARG 5 -13.713 5.229 -7.566
33 HA ARG 5 HA ARG 5 -11.984 4.215 -8.598
34 1HB ARG 5 2HB ARG 5 -10.475 6.614 -7.575
35 2HB ARG 5 1HB ARG 5 -9.767 5.408 -8.636
36 1HG ARG 5 2HG ARG 5 -11.676 5.938 -10.240
37 2HG ARG 5 1HG ARG 5 -11.971 7.356 -9.227
38 1HD ARG 5 2HD ARG 5 -9.680 8.104 -9.590
39 2HD ARG 5 1HD ARG 5 -9.353 6.675 -10.566
40 HE ARG 5 HE ARG 5 -10.621 9.079 -11.414
41 1HH1 ARG 5 1HH1 ARG 5 -10.624 5.611 -11.951
42 2HH1 ARG 5 2HH1 ARG 5 -11.107 5.749 -13.616
43 1HH2 ARG 5 1HH2 ARG 5 -11.238 9.255 -13.605
44 2HH2 ARG 5 2HH2 ARG 5 -11.476 7.808 -14.548
45 H THR 6 H THR 6 -9.637 3.423 -8.230
46 HA THR 6 HA THR 6 -8.811 2.939 -5.528
47 HB THR 6 HB THR 6 -9.837 0.584 -7.150
48 HG1 THR 6 1HG THR 6 -11.097 2.211 -5.429
49 1HG2 THR 6 1HG2 THR 6 -7.846 0.024 -5.847
50 2HG2 THR 6 2HG2 THR 6 -9.280 -0.755 -5.176
51 3HG2 THR 6 3HG2 THR 6 -8.605 0.675 -4.394
52 H SER 7 H SER 7 -8.593 2.368 -8.963
53 HA SER 7 HA SER 7 -6.233 1.049 -9.293
54 1HB SER 7 2HB SER 7 -7.154 3.432 -10.913
55 2HB SER 7 1HB SER 7 -6.048 2.166 -11.451
56 HG SER 7 HG SER 7 -8.431 2.038 -12.003
57 H PHE 8 H PHE 8 -6.604 4.533 -8.670
58 HA PHE 8 HA PHE 8 -3.910 5.233 -9.018
59 1HB PHE 8 2HB PHE 8 -5.773 6.863 -8.943
60 2HB PHE 8 1HB PHE 8 -5.958 6.549 -7.221
61 HD1 PHE 8 1HD PHE 8 -4.578 7.619 -5.629
62 HD2 PHE 8 2HD PHE 8 -3.676 7.932 -9.779
63 HE1 PHE 8 1HE PHE 8 -2.920 9.372 -5.136
64 HE2 PHE 8 2HE PHE 8 -2.018 9.681 -9.290
65 HZ PHE 8 HZ PHE 8 -1.638 10.404 -6.968
66 H VAL 9 H VAL 9 -5.714 4.398 -6.083
67 HA VAL 9 HA VAL 9 -3.583 4.720 -4.272
68 HB VAL 9 HB VAL 9 -5.998 2.917 -4.016
69 1HG1 VAL 9 1HG1 VAL 9 -4.305 2.326 -2.398
70 2HG1 VAL 9 2HG1 VAL 9 -5.630 3.159 -1.586
71 3HG1 VAL 9 3HG1 VAL 9 -4.126 4.014 -1.921
72 1HG2 VAL 9 1HG2 VAL 9 -6.662 5.210 -4.446
73 2HG2 VAL 9 2HG2 VAL 9 -5.602 5.780 -3.157
74 3HG2 VAL 9 3HG2 VAL 9 -7.002 4.781 -2.771
75 H LYS 10 H LYS 10 -4.812 1.884 -6.005
76 HA LYS 10 HA LYS 10 -3.010 0.058 -4.792
77 1HB LYS 10 2HB LYS 10 -5.128 -0.664 -5.782
78 2HB LYS 10 1HB LYS 10 -4.562 -0.178 -7.375
79 1HG LYS 10 2HG LYS 10 -2.997 -1.917 -7.474
80 2HG LYS 10 1HG LYS 10 -3.104 -2.226 -5.741
81 1HD LYS 10 2HD LYS 10 -4.266 -3.948 -7.034
82 2HD LYS 10 1HD LYS 10 -5.380 -3.045 -6.009
83 1HE LYS 10 2HE LYS 10 -5.996 -1.665 -7.970
84 2HE LYS 10 1HE LYS 10 -4.957 -2.679 -8.971
85 1HZ LYS 10 1HZ LYS 10 -7.304 -3.335 -9.075
86 2HZ LYS 10 2HZ LYS 10 -7.286 -3.660 -7.405
87 3HZ LYS 10 3HZ LYS 10 -6.325 -4.577 -8.459
88 H ARG 11 H ARG 11 -2.819 2.139 -7.599
89 HA ARG 11 HA ARG 11 -0.545 0.962 -8.786
90 1HB ARG 11 2HB ARG 11 -1.974 2.650 -9.919
91 2HB ARG 11 1HB ARG 11 -1.347 3.879 -8.828
92 1HG ARG 11 2HG ARG 11 -0.196 4.027 -10.927
93 2HG ARG 11 1HG ARG 11 0.927 3.437 -9.698
94 1HD ARG 11 2HD ARG 11 0.415 1.109 -10.486
95 2HD ARG 11 1HD ARG 11 -0.482 1.828 -11.822
96 HE ARG 11 HE ARG 11 2.414 2.251 -11.369
97 1HH1 ARG 11 1HH1 ARG 11 -0.337 1.780 -13.501
98 2HH1 ARG 11 2HH1 ARG 11 0.613 1.824 -14.954
99 1HH2 ARG 11 1HH2 ARG 11 3.673 2.244 -13.274
100 2HH2 ARG 11 2HH2 ARG 11 2.904 2.061 -14.824
101 H ILE 12 H ILE 12 -0.924 3.484 -6.330
102 HA ILE 12 HA ILE 12 1.776 4.147 -5.999
103 HB ILE 12 HB ILE 12 -0.411 4.120 -3.907
104 1HG1 ILE 12 2HG1 ILE 12 -0.991 5.511 -5.826
105 2HG1 ILE 12 1HG1 ILE 12 -0.630 6.520 -4.431
106 1HG2 ILE 12 1HG2 ILE 12 0.965 5.761 -2.711
107 2HG2 ILE 12 2HG2 ILE 12 2.240 5.559 -3.914
108 3HG2 ILE 12 3HG2 ILE 12 1.786 4.208 -2.875
109 1HD1 ILE 12 1HD1 ILE 12 0.313 7.462 -6.451
110 2HD1 ILE 12 2HD1 ILE 12 1.213 5.975 -6.746
111 3HD1 ILE 12 3HD1 ILE 12 1.594 6.969 -5.340
112 H ALA 13 H ALA 13 -0.205 1.656 -4.446
113 HA ALA 13 HA ALA 13 1.805 0.595 -2.782
114 1HB ALA 13 1HB ALA 13 0.384 -1.372 -2.606
115 2HB ALA 13 2HB ALA 13 -0.563 -0.833 -3.993
116 3HB ALA 13 3HB ALA 13 -0.582 0.098 -2.495
117 H LYS 14 H LYS 14 0.776 -0.197 -6.075
118 HA LYS 14 HA LYS 14 2.456 -2.381 -6.541
119 1HB LYS 14 2HB LYS 14 0.628 -1.775 -8.040
120 2HB LYS 14 1HB LYS 14 1.448 -0.285 -8.474
121 1HG LYS 14 2HG LYS 14 1.772 -1.767 -10.270
122 2HG LYS 14 1HG LYS 14 3.306 -1.706 -9.406
123 1HD LYS 14 2HD LYS 14 1.377 -3.840 -8.653
124 2HD LYS 14 1HD LYS 14 2.205 -3.993 -10.201
125 1HE LYS 14 2HE LYS 14 4.369 -3.710 -8.999
126 2HE LYS 14 1HE LYS 14 3.475 -3.744 -7.479
127 1HZ LYS 14 1HZ LYS 14 3.381 -5.936 -9.478
128 2HZ LYS 14 2HZ LYS 14 2.795 -5.969 -7.884
129 3HZ LYS 14 3HZ LYS 14 4.463 -5.913 -8.174
130 H GLU 15 H GLU 15 3.044 1.099 -6.954
131 HA GLU 15 HA GLU 15 5.565 0.969 -8.139
132 1HB GLU 15 2HB GLU 15 4.530 3.010 -6.159
133 2HB GLU 15 1HB GLU 15 5.960 3.216 -7.157
134 1HG GLU 15 2HG GLU 15 3.118 2.965 -8.109
135 2HG GLU 15 1HG GLU 15 4.116 4.416 -8.116
136 H MET 16 H MET 16 4.701 1.031 -4.695
137 HA MET 16 HA MET 16 7.353 0.842 -3.717
138 1HB MET 16 2HB MET 16 5.537 1.575 -2.273
139 2HB MET 16 1HB MET 16 4.740 0.016 -2.439
140 1HG MET 16 2HG MET 16 6.784 -1.014 -1.390
141 2HG MET 16 1HG MET 16 7.319 0.624 -1.024
142 1HE MET 16 1HE MET 16 4.467 1.873 1.367
143 2HE MET 16 2HE MET 16 4.576 2.080 -0.382
144 3HE MET 16 3HE MET 16 6.014 2.275 0.621
145 H ILE 17 H ILE 17 4.832 -1.598 -4.227
146 HA ILE 17 HA ILE 17 6.217 -3.819 -3.265
147 HB ILE 17 HB ILE 17 4.078 -3.662 -5.392
148 1HG1 ILE 17 2HG1 ILE 17 3.925 -4.431 -2.470
149 2HG1 ILE 17 1HG1 ILE 17 3.451 -2.868 -3.123
150 1HG2 ILE 17 1HG2 ILE 17 5.331 -5.737 -5.647
151 2HG2 ILE 17 2HG2 ILE 17 3.715 -6.051 -5.015
152 3HG2 ILE 17 3HG2 ILE 17 5.109 -6.093 -3.935
153 1HD1 ILE 17 1HD1 ILE 17 2.192 -5.512 -3.814
154 2HD1 ILE 17 2HD1 ILE 17 1.700 -3.935 -4.433
155 3HD1 ILE 17 3HD1 ILE 17 1.526 -4.304 -2.717
156 H GLU 18 H GLU 18 6.058 -2.505 -6.555
157 HA GLU 18 HA GLU 18 7.505 -4.611 -7.770
158 1HB GLU 18 2HB GLU 18 5.999 -2.787 -8.836
159 2HB GLU 18 1HB GLU 18 7.456 -1.802 -8.838
160 1HG GLU 18 2HG GLU 18 7.184 -2.861 -10.977
161 2HG GLU 18 1HG GLU 18 8.596 -3.533 -10.161
162 H THR 19 H THR 19 8.476 -1.416 -6.591
163 HA THR 19 HA THR 19 11.162 -1.614 -7.472
164 HB THR 19 HB THR 19 10.102 0.151 -5.258
165 HG1 THR 19 1HG THR 19 8.845 0.750 -6.917
166 1HG2 THR 19 1HG2 THR 19 12.427 0.471 -7.160
167 2HG2 THR 19 2HG2 THR 19 12.541 0.105 -5.439
168 3HG2 THR 19 3HG2 THR 19 11.904 1.663 -5.968
169 H HIS 20 H HIS 20 9.566 -2.258 -4.366
170 HA HIS 20 HA HIS 20 12.069 -3.525 -3.474
171 1HB HIS 20 2HB HIS 20 10.083 -1.948 -1.837
172 2HB HIS 20 1HB HIS 20 11.303 -2.994 -1.119
173 HD1 HIS 20 1HD HIS 20 13.684 -2.125 -0.990
174 HD2 HIS 20 2HD HIS 20 11.127 0.386 -3.108
175 HE1 HIS 20 1HE HIS 20 14.976 -0.004 -1.382
176 HE2 HIS 20 2HE HIS 20 13.498 1.406 -2.853
177 HA PRO 21 HA PRO 21 9.013 -6.880 -3.472
178 1HB PRO 21 2HB PRO 21 11.127 -8.638 -4.289
179 2HB PRO 21 1HB PRO 21 9.768 -8.052 -5.249
180 1HG PRO 21 2HG PRO 21 12.402 -7.376 -5.696
181 2HG PRO 21 1HG PRO 21 11.012 -6.417 -6.228
182 1HD PRO 21 2HD PRO 21 12.784 -6.030 -3.846
183 2HD PRO 21 1HD PRO 21 12.078 -4.817 -4.940
184 H GLY 22 H GLY 22 11.710 -6.165 -1.640
185 1HA GLY 22 2HA GLY 22 12.072 -8.656 -0.275
186 2HA GLY 22 1HA GLY 22 12.730 -7.099 0.206
187 H LYS 23 H LYS 23 9.543 -8.644 -0.047
188 HA LYS 23 HA LYS 23 9.040 -8.581 2.729
189 1HB LYS 23 2HB LYS 23 7.062 -6.978 2.596
190 2HB LYS 23 1HB LYS 23 8.663 -6.256 2.610
191 1HG LYS 23 2HG LYS 23 7.628 -5.021 0.983
192 2HG LYS 23 1HG LYS 23 8.388 -6.280 0.011
193 1HD LYS 23 2HD LYS 23 6.267 -7.512 -0.035
194 2HD LYS 23 1HD LYS 23 5.510 -6.242 0.930
195 1HE LYS 23 2HE LYS 23 4.952 -5.913 -1.388
196 2HE LYS 23 1HE LYS 23 6.035 -4.624 -0.867
197 1HZ LYS 23 1HZ LYS 23 6.799 -7.036 -2.431
198 2HZ LYS 23 2HZ LYS 23 7.877 -5.838 -1.893
199 3HZ LYS 23 3HZ LYS 23 6.681 -5.453 -3.021
200 H PHE 24 H PHE 24 7.227 -9.812 3.257
201 HA PHE 24 HA PHE 24 5.327 -10.682 1.316
202 1HB PHE 24 2HB PHE 24 7.458 -11.843 0.593
203 2HB PHE 24 1HB PHE 24 7.409 -12.728 2.112
204 HD1 PHE 24 1HD PHE 24 5.169 -11.945 -0.772
205 HD2 PHE 24 2HD PHE 24 6.475 -14.822 2.082
206 HE1 PHE 24 1HE PHE 24 3.726 -13.640 -1.824
207 HE2 PHE 24 2HE PHE 24 5.035 -16.519 1.038
208 HZ PHE 24 HZ PHE 24 3.659 -15.930 -0.916
209 H THR 25 H THR 25 4.938 -9.625 3.746
210 HA THR 25 HA THR 25 3.790 -11.864 5.237
211 HB THR 25 HB THR 25 4.456 -10.263 7.307
212 HG1 THR 25 1HG THR 25 5.982 -8.937 6.730
213 1HG2 THR 25 1HG2 THR 25 6.287 -11.817 7.774
214 2HG2 THR 25 2HG2 THR 25 6.244 -12.374 6.101
215 3HG2 THR 25 3HG2 THR 25 4.869 -12.673 7.163
216 H ASP 26 H ASP 26 1.899 -11.337 6.419
217 HA ASP 26 HA ASP 26 0.621 -8.912 5.342
218 1HB ASP 26 2HB ASP 26 -1.508 -10.076 5.529
219 2HB ASP 26 1HB ASP 26 -0.373 -11.035 4.591
220 H ASP 27 H ASP 27 2.207 -9.310 7.901
221 HA ASP 27 HA ASP 27 0.202 -8.640 9.898
222 1HB ASP 27 2HB ASP 27 2.125 -8.511 11.459
223 2HB ASP 27 1HB ASP 27 2.027 -10.061 10.631
224 H PHE 28 H PHE 28 0.462 -6.690 11.226
225 HA PHE 28 HA PHE 28 0.511 -4.419 9.511
226 1HB PHE 28 2HB PHE 28 0.061 -4.775 12.457
227 2HB PHE 28 1HB PHE 28 0.162 -3.171 11.739
228 HD1 PHE 28 1HD PHE 28 -1.570 -2.344 10.286
229 HD2 PHE 28 2HD PHE 28 -1.802 -6.247 11.964
230 HE1 PHE 28 1HE PHE 28 -3.947 -2.465 9.662
231 HE2 PHE 28 2HE PHE 28 -4.179 -6.378 11.340
232 HZ PHE 28 HZ PHE 28 -5.254 -4.484 10.187
233 H ASP 29 H ASP 29 2.825 -5.806 11.717
234 HA ASP 29 HA ASP 29 4.461 -3.524 12.036
235 1HB ASP 29 2HB ASP 29 4.698 -5.441 13.508
236 2HB ASP 29 1HB ASP 29 5.166 -6.464 12.151
237 H THR 30 H THR 30 4.332 -6.073 9.628
238 HA THR 30 HA THR 30 6.615 -5.404 8.170
239 HB THR 30 HB THR 30 4.026 -6.665 7.269
240 HG1 THR 30 1HG THR 30 5.074 -8.012 8.676
241 1HG2 THR 30 1HG2 THR 30 5.266 -7.453 5.309
242 2HG2 THR 30 2HG2 THR 30 6.670 -6.512 5.813
243 3HG2 THR 30 3HG2 THR 30 5.180 -5.691 5.342
244 H ASN 31 H ASN 31 3.214 -4.408 7.481
245 HA ASN 31 HA ASN 31 4.020 -2.643 5.414
246 1HB ASN 31 2HB ASN 31 1.761 -1.731 5.465
247 2HB ASN 31 1HB ASN 31 1.716 -3.486 5.538
248 1HD2 ASN 31 1HD2 ASN 31 1.244 -0.529 7.341
249 2HD2 ASN 31 2HD2 ASN 31 0.330 -1.238 8.622
250 H LYS 32 H LYS 32 3.849 -2.325 8.858
251 HA LYS 32 HA LYS 32 4.027 0.473 9.065
252 1HB LYS 32 2HB LYS 32 3.717 -1.194 10.961
253 2HB LYS 32 1HB LYS 32 5.443 -1.506 10.859
254 1HG LYS 32 2HG LYS 32 5.798 0.950 11.262
255 2HG LYS 32 1HG LYS 32 4.073 1.060 11.615
256 1HD LYS 32 2HD LYS 32 5.099 0.796 13.710
257 2HD LYS 32 1HD LYS 32 4.477 -0.806 13.311
258 1HE LYS 32 2HE LYS 32 6.662 -1.148 14.140
259 2HE LYS 32 1HE LYS 32 6.779 -1.325 12.389
260 1HZ LYS 32 1HZ LYS 32 7.497 1.068 12.346
261 2HZ LYS 32 2HZ LYS 32 8.595 0.002 13.082
262 3HZ LYS 32 3HZ LYS 32 7.611 0.998 14.038
263 H LYS 33 H LYS 33 6.570 -2.016 8.938
264 HA LYS 33 HA LYS 33 8.809 -0.362 8.826
265 1HB LYS 33 2HB LYS 33 8.297 -3.082 7.628
266 2HB LYS 33 1HB LYS 33 9.873 -2.306 7.592
267 1HG LYS 33 2HG LYS 33 10.055 -2.382 9.959
268 2HG LYS 33 1HG LYS 33 8.367 -2.875 10.130
269 1HD LYS 33 2HD LYS 33 8.820 -4.988 9.072
270 2HD LYS 33 1HD LYS 33 10.472 -4.496 8.703
271 1HE LYS 33 2HE LYS 33 9.406 -4.679 11.507
272 2HE LYS 33 1HE LYS 33 10.163 -6.040 10.683
273 1HZ LYS 33 1HZ LYS 33 11.710 -4.787 12.094
274 2HZ LYS 33 2HZ LYS 33 11.467 -3.409 11.138
275 3HZ LYS 33 3HZ LYS 33 12.185 -4.792 10.468
276 H LEU 34 H LEU 34 6.672 -1.462 6.252
277 HA LEU 34 HA LEU 34 8.186 -0.608 4.066
278 1HB LEU 34 2HB LEU 34 5.350 -1.300 4.539
279 2HB LEU 34 1HB LEU 34 5.680 -0.331 3.117
280 HG LEU 34 HG LEU 34 7.153 -2.036 2.227
281 1HD1 LEU 34 1HD1 LEU 34 7.440 -4.204 3.337
282 2HD1 LEU 34 2HD1 LEU 34 6.578 -3.588 4.748
283 3HD1 LEU 34 3HD1 LEU 34 8.127 -2.883 4.286
284 1HD2 LEU 34 1HD2 LEU 34 4.560 -3.218 3.199
285 2HD2 LEU 34 2HD2 LEU 34 5.536 -3.826 1.862
286 3HD2 LEU 34 3HD2 LEU 34 4.777 -2.239 1.750
287 H VAL 35 H VAL 35 5.561 1.131 5.777
288 HA VAL 35 HA VAL 35 6.101 3.513 4.222
289 HB VAL 35 HB VAL 35 4.352 4.592 5.564
290 1HG1 VAL 35 1HG1 VAL 35 2.477 3.230 4.801
291 2HG1 VAL 35 2HG1 VAL 35 3.563 1.863 4.551
292 3HG1 VAL 35 3HG1 VAL 35 3.741 3.321 3.573
293 1HG2 VAL 35 1HG2 VAL 35 4.191 1.957 7.029
294 2HG2 VAL 35 2HG2 VAL 35 3.073 3.309 7.210
295 3HG2 VAL 35 3HG2 VAL 35 4.758 3.488 7.700
296 H GLU 36 H GLU 36 7.450 2.109 6.921
297 HA GLU 36 HA GLU 36 8.082 4.443 8.453
298 1HB GLU 36 2HB GLU 36 8.072 1.811 9.005
299 2HB GLU 36 1HB GLU 36 9.777 2.013 8.637
300 1HG GLU 36 2HG GLU 36 9.582 2.259 10.956
301 2HG GLU 36 1HG GLU 36 9.787 3.891 10.317
302 H GLU 37 H GLU 37 9.086 3.575 5.457
303 HA GLU 37 HA GLU 37 11.598 4.986 5.626
304 1HB GLU 37 2HB GLU 37 12.202 2.732 6.430
305 2HB GLU 37 1HB GLU 37 11.560 2.037 4.951
306 1HG GLU 37 2HG GLU 37 13.925 2.103 4.770
307 2HG GLU 37 1HG GLU 37 13.266 3.323 3.683
308 H PHE 38 H PHE 38 9.603 2.792 3.659
309 HA PHE 38 HA PHE 38 10.722 3.859 1.211
310 1HB PHE 38 2HB PHE 38 8.482 1.852 1.548
311 2HB PHE 38 1HB PHE 38 9.414 2.160 0.086
312 HD1 PHE 38 1HD PHE 38 9.012 -0.053 2.685
313 HD2 PHE 38 2HD PHE 38 12.083 1.981 0.553
314 HE1 PHE 38 1HE PHE 38 10.625 -1.775 3.378
315 HE2 PHE 38 2HE PHE 38 13.701 0.260 1.239
316 HZ PHE 38 HZ PHE 38 12.972 -1.622 2.653
317 H SER 39 H SER 39 8.564 3.759 -0.479
318 HA SER 39 HA SER 39 6.957 5.007 -1.419
319 1HB SER 39 2HB SER 39 5.025 5.714 -0.123
320 2HB SER 39 1HB SER 39 5.516 4.095 0.359
321 HG SER 39 HG SER 39 6.772 5.399 2.050
322 H THR 40 H THR 40 5.821 7.260 -1.315
323 HA THR 40 HA THR 40 7.373 9.389 -0.220
324 HB THR 40 HB THR 40 8.819 8.719 -2.128
325 HG1 THR 40 1HG THR 40 9.201 10.792 -2.006
326 1HG2 THR 40 1HG2 THR 40 7.142 7.832 -3.640
327 2HG2 THR 40 2HG2 THR 40 8.054 9.115 -4.434
328 3HG2 THR 40 3HG2 THR 40 6.428 9.432 -3.826
329 H VAL 41 H VAL 41 6.537 11.352 -2.113
330 HA VAL 41 HA VAL 41 4.763 12.575 -2.857
331 HB VAL 41 HB VAL 41 3.056 10.154 -2.213
332 1HG1 VAL 41 1HG1 VAL 41 2.366 12.629 -3.797
333 2HG1 VAL 41 2HG1 VAL 41 1.726 12.208 -2.209
334 3HG1 VAL 41 3HG1 VAL 41 1.343 11.204 -3.609
335 1HG2 VAL 41 1HG2 VAL 41 4.682 9.711 -3.973
336 2HG2 VAL 41 2HG2 VAL 41 4.149 11.149 -4.844
337 3HG2 VAL 41 3HG2 VAL 41 3.049 9.785 -4.634
338 H SER 42 H SER 42 3.212 13.976 -1.928
339 HA SER 42 HA SER 42 3.637 14.292 0.894
340 1HB SER 42 2HB SER 42 3.618 16.166 -0.809
341 2HB SER 42 1HB SER 42 1.872 15.957 -0.911
342 HG SER 42 HG SER 42 3.151 17.455 0.780
343 H THR 43 H THR 43 1.355 15.418 1.828
344 HA THR 43 HA THR 43 -0.576 14.940 2.895
345 HB THR 43 HB THR 43 -1.085 12.829 0.787
346 HG1 THR 43 1HG THR 43 -0.924 15.509 0.553
347 1HG2 THR 43 1HG2 THR 43 -2.969 14.380 2.578
348 2HG2 THR 43 2HG2 THR 43 -2.540 12.678 2.764
349 3HG2 THR 43 3HG2 THR 43 -3.445 13.212 1.347
350 H LYS 44 H LYS 44 0.662 14.239 4.618
351 HA LYS 44 HA LYS 44 1.811 11.702 4.913
352 1HB LYS 44 2HB LYS 44 1.825 12.343 7.383
353 2HB LYS 44 1HB LYS 44 2.661 13.419 6.270
354 1HG LYS 44 2HG LYS 44 0.620 14.860 6.252
355 2HG LYS 44 1HG LYS 44 -0.046 13.829 7.520
356 1HD LYS 44 2HD LYS 44 1.733 14.412 9.015
357 2HD LYS 44 1HD LYS 44 2.584 15.287 7.740
358 1HE LYS 44 2HE LYS 44 -0.111 16.009 8.886
359 2HE LYS 44 1HE LYS 44 1.414 16.809 9.263
360 1HZ LYS 44 1HZ LYS 44 0.062 16.734 6.617
361 2HZ LYS 44 2HZ LYS 44 1.596 17.395 6.887
362 3HZ LYS 44 3HZ LYS 44 0.235 18.081 7.627
363 H HIS 45 H HIS 45 -1.456 12.787 5.442
364 HA HIS 45 HA HIS 45 -2.145 10.592 7.177
365 1HB HIS 45 2HB HIS 45 -3.285 12.841 7.189
366 2HB HIS 45 1HB HIS 45 -4.023 12.408 5.651
367 HD1 HIS 45 1HD HIS 45 -6.279 11.407 5.851
368 HD2 HIS 45 2HD HIS 45 -4.004 10.821 9.289
369 HE1 HIS 45 1HE HIS 45 -7.801 10.256 7.489
370 HE2 HIS 45 2HE HIS 45 -6.413 9.907 9.566
371 H LEU 46 H LEU 46 -1.660 10.924 3.864
372 HA LEU 46 HA LEU 46 -3.690 9.106 2.961
373 1HB LEU 46 2HB LEU 46 -2.808 10.867 1.506
374 2HB LEU 46 1HB LEU 46 -1.217 10.133 1.569
375 HG LEU 46 HG LEU 46 -2.136 8.122 0.435
376 1HD1 LEU 46 1HD1 LEU 46 -4.339 8.258 -0.620
377 2HD1 LEU 46 2HD1 LEU 46 -4.627 9.806 0.173
378 3HD1 LEU 46 3HD1 LEU 46 -4.461 8.339 1.137
379 1HD2 LEU 46 1HD2 LEU 46 -1.025 9.863 -0.854
380 2HD2 LEU 46 2HD2 LEU 46 -2.548 10.737 -1.014
381 3HD2 LEU 46 3HD2 LEU 46 -2.350 9.159 -1.776
382 H ARG 47 H ARG 47 -0.248 8.876 3.745
383 HA ARG 47 HA ARG 47 0.028 6.254 2.687
384 1HB ARG 47 2HB ARG 47 2.195 6.211 3.971
385 2HB ARG 47 1HB ARG 47 2.019 7.498 2.793
386 1HG ARG 47 2HG ARG 47 3.017 8.541 4.600
387 2HG ARG 47 1HG ARG 47 1.315 8.952 4.795
388 1HD ARG 47 2HD ARG 47 1.042 7.502 6.590
389 2HD ARG 47 1HD ARG 47 2.458 6.544 6.156
390 HE ARG 47 HE ARG 47 3.517 8.967 6.733
391 1HH1 ARG 47 1HH1 ARG 47 1.248 6.960 8.485
392 2HH1 ARG 47 2HH1 ARG 47 1.900 7.355 10.046
393 1HH2 ARG 47 1HH2 ARG 47 4.388 9.485 8.765
394 2HH2 ARG 47 2HH2 ARG 47 3.687 8.812 10.204
395 H ASN 48 H ASN 48 -1.446 7.368 5.494
396 HA ASN 48 HA ASN 48 -1.130 5.054 7.122
397 1HB ASN 48 2HB ASN 48 -3.302 7.155 7.004
398 2HB ASN 48 1HB ASN 48 -3.292 5.851 8.182
399 1HD2 ASN 48 1HD2 ASN 48 -3.155 7.269 9.901
400 2HD2 ASN 48 2HD2 ASN 48 -1.691 8.124 10.275
401 H LYS 49 H LYS 49 -3.431 6.048 4.654
402 HA LYS 49 HA LYS 49 -5.067 3.713 4.853
403 1HB LYS 49 2HB LYS 49 -4.834 5.617 2.515
404 2HB LYS 49 1HB LYS 49 -6.175 4.538 2.870
405 1HG LYS 49 2HG LYS 49 -5.344 6.948 4.476
406 2HG LYS 49 1HG LYS 49 -6.754 6.816 3.425
407 1HD LYS 49 2HD LYS 49 -7.653 5.048 4.872
408 2HD LYS 49 1HD LYS 49 -6.248 5.210 5.931
409 1HE LYS 49 2HE LYS 49 -6.872 7.576 6.313
410 2HE LYS 49 1HE LYS 49 -8.319 7.321 5.342
411 1HZ LYS 49 1HZ LYS 49 -7.647 5.924 7.875
412 2HZ LYS 49 2HZ LYS 49 -9.032 5.634 6.938
413 3HZ LYS 49 3HZ LYS 49 -8.811 7.144 7.688
414 H ILE 50 H ILE 50 -2.406 4.783 2.823
415 HA ILE 50 HA ILE 50 -2.335 2.709 0.967
416 HB ILE 50 HB ILE 50 0.015 4.192 2.163
417 1HG1 ILE 50 2HG1 ILE 50 -1.613 5.718 1.172
418 2HG1 ILE 50 1HG1 ILE 50 -0.165 5.641 0.173
419 1HG2 ILE 50 1HG2 ILE 50 0.735 2.168 1.030
420 2HG2 ILE 50 2HG2 ILE 50 1.198 3.591 0.098
421 3HG2 ILE 50 3HG2 ILE 50 -0.188 2.622 -0.404
422 1HD1 ILE 50 1HD1 ILE 50 -2.773 4.238 -0.358
423 2HD1 ILE 50 2HD1 ILE 50 -1.324 4.121 -1.358
424 3HD1 ILE 50 3HD1 ILE 50 -2.160 5.666 -1.193
425 H ALA 51 H ALA 51 -0.715 2.971 4.119
426 HA ALA 51 HA ALA 51 0.645 0.541 4.081
427 1HB ALA 51 1HB ALA 51 0.804 0.771 6.493
428 2HB ALA 51 2HB ALA 51 -0.486 1.974 6.480
429 3HB ALA 51 3HB ALA 51 1.058 2.329 5.707
430 H GLY 52 H GLY 52 -2.556 1.290 5.455
431 1HA GLY 52 2HA GLY 52 -3.066 -1.332 6.390
432 2HA GLY 52 1HA GLY 52 -4.272 -0.079 6.136
433 H TYR 53 H TYR 53 -3.527 0.170 3.272
434 HA TYR 53 HA TYR 53 -5.315 -1.824 2.276
435 1HB TYR 53 2HB TYR 53 -5.103 0.532 1.370
436 2HB TYR 53 1HB TYR 53 -3.582 0.034 0.638
437 HD1 TYR 53 1HD TYR 53 -3.760 -0.337 -1.632
438 HD2 TYR 53 2HD TYR 53 -7.021 -1.423 0.879
439 HE1 TYR 53 1HE TYR 53 -4.983 -1.184 -3.592
440 HE2 TYR 53 2HE TYR 53 -8.250 -2.274 -1.071
441 HH TYR 53 HH TYR 53 -8.314 -2.019 -3.458
442 H ILE 54 H ILE 54 -1.823 -1.302 2.192
443 HA ILE 54 HA ILE 54 -1.112 -3.373 0.445
444 HB ILE 54 HB ILE 54 0.404 -2.402 2.877
445 1HG1 ILE 54 2HG1 ILE 54 0.716 -1.599 -0.021
446 2HG1 ILE 54 1HG1 ILE 54 -0.162 -0.655 1.178
447 1HG2 ILE 54 1HG2 ILE 54 1.221 -4.564 2.125
448 2HG2 ILE 54 2HG2 ILE 54 2.392 -3.301 1.752
449 3HG2 ILE 54 3HG2 ILE 54 1.366 -3.957 0.476
450 1HD1 ILE 54 1HD1 ILE 54 1.886 -0.411 2.482
451 2HD1 ILE 54 2HD1 ILE 54 2.070 0.222 0.847
452 3HD1 ILE 54 3HD1 ILE 54 2.764 -1.343 1.270
453 H THR 55 H THR 55 -1.519 -3.377 3.971
454 HA THR 55 HA THR 55 -0.928 -6.034 4.512
455 HB THR 55 HB THR 55 -3.201 -4.749 5.958
456 HG1 THR 55 1HG THR 55 -0.736 -3.851 6.784
457 1HG2 THR 55 1HG2 THR 55 -1.985 -5.586 7.912
458 2HG2 THR 55 2HG2 THR 55 -0.670 -6.121 6.867
459 3HG2 THR 55 3HG2 THR 55 -2.258 -6.876 6.739
460 H ARG 56 H ARG 56 -3.966 -4.532 3.519
461 HA ARG 56 HA ARG 56 -5.553 -6.863 3.662
462 1HB ARG 56 2HB ARG 56 -6.547 -4.648 3.637
463 2HB ARG 56 1HB ARG 56 -5.912 -4.349 2.025
464 1HG ARG 56 2HG ARG 56 -7.363 -6.001 1.079
465 2HG ARG 56 1HG ARG 56 -7.886 -6.524 2.680
466 1HD ARG 56 2HD ARG 56 -8.317 -3.753 1.578
467 2HD ARG 56 1HD ARG 56 -9.513 -5.047 1.496
468 HE ARG 56 HE ARG 56 -8.456 -4.115 4.092
469 1HH1 ARG 56 1HH1 ARG 56 -11.114 -4.685 1.889
470 2HH1 ARG 56 2HH1 ARG 56 -12.345 -4.472 3.104
471 1HH2 ARG 56 1HH2 ARG 56 -10.080 -3.810 5.709
472 2HH2 ARG 56 2HH2 ARG 56 -11.751 -3.962 5.262
473 H ILE 57 H ILE 57 -3.792 -5.343 0.968
474 HA ILE 57 HA ILE 57 -4.618 -7.067 -1.068
475 HB ILE 57 HB ILE 57 -1.939 -5.703 -0.757
476 1HG1 ILE 57 2HG1 ILE 57 -4.394 -4.887 -2.333
477 2HG1 ILE 57 1HG1 ILE 57 -3.885 -4.171 -0.807
478 1HG2 ILE 57 1HG2 ILE 57 -3.193 -6.952 -3.203
479 2HG2 ILE 57 2HG2 ILE 57 -1.772 -7.541 -2.336
480 3HG2 ILE 57 3HG2 ILE 57 -1.712 -5.995 -3.187
481 1HD1 ILE 57 1HD1 ILE 57 -3.245 -2.764 -2.660
482 2HD1 ILE 57 2HD1 ILE 57 -2.363 -4.100 -3.400
483 3HD1 ILE 57 3HD1 ILE 57 -1.809 -3.417 -1.869
484 H ILE 58 H ILE 58 -1.804 -7.322 1.091
485 HA ILE 58 HA ILE 58 -0.784 -9.692 -0.032
486 HB ILE 58 HB ILE 58 -0.437 -8.647 2.783
487 1HG1 ILE 58 2HG1 ILE 58 1.302 -8.320 0.324
488 2HG1 ILE 58 1HG1 ILE 58 0.261 -7.070 0.998
489 1HG2 ILE 58 1HG2 ILE 58 1.588 -10.025 2.829
490 2HG2 ILE 58 2HG2 ILE 58 1.189 -10.667 1.235
491 3HG2 ILE 58 3HG2 ILE 58 0.142 -11.012 2.613
492 1HD1 ILE 58 1HD1 ILE 58 2.649 -8.321 2.337
493 2HD1 ILE 58 2HD1 ILE 58 1.591 -7.108 3.059
494 3HD1 ILE 58 3HD1 ILE 58 2.557 -6.703 1.640
495 H SER 59 H SER 59 -2.854 -9.207 2.836
496 HA SER 59 HA SER 59 -3.080 -11.961 3.445
497 1HB SER 59 2HB SER 59 -5.062 -11.204 4.827
498 2HB SER 59 1HB SER 59 -3.537 -10.394 5.180
499 HG SER 59 HG SER 59 -4.251 -8.579 4.231
500 H GLN 60 H GLN 60 -4.737 -9.921 1.187
501 HA GLN 60 HA GLN 60 -7.023 -11.560 0.773
502 1HB GLN 60 2HB GLN 60 -6.796 -9.138 0.134
503 2HB GLN 60 1HB GLN 60 -5.732 -9.638 -1.169
504 1HG GLN 60 2HG GLN 60 -7.539 -10.905 -2.182
505 2HG GLN 60 1HG GLN 60 -8.611 -10.451 -0.855
506 1HE2 GLN 60 1HE2 GLN 60 -6.945 -9.360 -3.695
507 2HE2 GLN 60 2HE2 GLN 60 -7.790 -7.860 -3.867
508 H GLN 61 H GLN 61 -3.790 -11.457 -0.590
509 HA GLN 61 HA GLN 61 -4.379 -13.535 -2.530
510 1HB GLN 61 2HB GLN 61 -1.700 -12.347 -1.778
511 2HB GLN 61 1HB GLN 61 -2.059 -13.307 -3.205
512 1HG GLN 61 2HG GLN 61 -3.392 -10.674 -2.670
513 2HG GLN 61 1HG GLN 61 -1.844 -10.795 -3.498
514 1HE2 GLN 61 1HE2 GLN 61 -4.396 -13.172 -3.901
515 2HE2 GLN 61 2HE2 GLN 61 -4.772 -12.758 -5.536
516 H LYS 62 H LYS 62 -2.924 -13.212 0.621
517 HA LYS 62 HA LYS 62 -1.933 -15.963 0.572
518 1HB LYS 62 2HB LYS 62 -0.355 -14.286 1.306
519 2HB LYS 62 1HB LYS 62 -1.494 -13.667 2.487
520 1HG LYS 62 2HG LYS 62 -1.299 -15.679 3.799
521 2HG LYS 62 1HG LYS 62 -0.262 -16.413 2.572
522 1HD LYS 62 2HD LYS 62 1.488 -14.884 2.995
523 2HD LYS 62 1HD LYS 62 0.436 -13.826 3.933
524 1HE LYS 62 2HE LYS 62 1.200 -16.628 4.739
525 2HE LYS 62 1HE LYS 62 2.005 -15.169 5.316
526 1HZ LYS 62 1HZ LYS 62 0.404 -15.815 6.932
527 2HZ LYS 62 2HZ LYS 62 -0.823 -15.952 5.774
528 3HZ LYS 62 3HZ LYS 62 -0.194 -14.424 6.169
Start of MODEL 15
1 1H MET 1 1HT MET 1 -11.771 11.610 -15.384
2 2H MET 1 2HT MET 1 -12.204 12.222 -13.864
3 3H MET 1 3HT MET 1 -13.370 11.471 -14.835
4 HA MET 1 HA MET 1 -12.651 10.029 -13.038
5 1HB MET 1 2HB MET 1 -11.749 9.122 -15.782
6 2HB MET 1 1HB MET 1 -12.071 8.061 -14.417
7 1HG MET 1 2HG MET 1 -14.073 9.817 -15.816
8 2HG MET 1 1HG MET 1 -13.926 8.068 -15.969
9 1HE MET 1 1HE MET 1 -17.289 8.556 -13.996
10 2HE MET 1 2HE MET 1 -16.534 7.834 -15.414
11 3HE MET 1 3HE MET 1 -16.638 9.589 -15.271
12 H GLY 2 H GLY 2 -9.998 10.848 -15.276
13 1HA GLY 2 2HA GLY 2 -7.822 11.417 -14.451
14 2HA GLY 2 1HA GLY 2 -8.130 10.412 -13.040
15 H ASN 3 H ASN 3 -7.250 8.443 -13.022
16 HA ASN 3 HA ASN 3 -6.189 7.404 -15.554
17 1HB ASN 3 2HB ASN 3 -5.548 6.615 -12.703
18 2HB ASN 3 1HB ASN 3 -4.838 5.878 -14.136
19 1HD2 ASN 3 1HD2 ASN 3 -3.348 7.027 -15.357
20 2HD2 ASN 3 2HD2 ASN 3 -2.572 8.451 -14.744
21 H ILE 4 H ILE 4 -8.097 6.613 -16.385
22 HA ILE 4 HA ILE 4 -9.634 5.041 -16.894
23 HB ILE 4 HB ILE 4 -8.267 3.332 -14.805
24 1HG1 ILE 4 2HG1 ILE 4 -7.916 3.429 -17.811
25 2HG1 ILE 4 1HG1 ILE 4 -6.776 4.070 -16.634
26 1HG2 ILE 4 1HG2 ILE 4 -9.311 1.445 -15.993
27 2HG2 ILE 4 2HG2 ILE 4 -10.177 2.589 -17.019
28 3HG2 ILE 4 3HG2 ILE 4 -10.510 2.532 -15.289
29 1HD1 ILE 4 1HD1 ILE 4 -6.036 1.926 -17.471
30 2HD1 ILE 4 2HD1 ILE 4 -7.553 1.182 -16.964
31 3HD1 ILE 4 3HD1 ILE 4 -6.431 1.811 -15.755
32 H ARG 5 H ARG 5 -9.260 4.370 -13.430
33 HA ARG 5 HA ARG 5 -11.953 5.416 -12.947
34 1HB ARG 5 2HB ARG 5 -12.053 2.922 -13.337
35 2HB ARG 5 1HB ARG 5 -11.042 2.722 -11.913
36 1HG ARG 5 2HG ARG 5 -12.840 4.003 -10.653
37 2HG ARG 5 1HG ARG 5 -13.852 3.755 -12.075
38 1HD ARG 5 2HD ARG 5 -12.605 1.642 -10.328
39 2HD ARG 5 1HD ARG 5 -14.317 2.027 -10.472
40 HE ARG 5 HE ARG 5 -12.980 1.161 -12.911
41 1HH1 ARG 5 1HH1 ARG 5 -15.033 0.348 -10.199
42 2HH1 ARG 5 2HH1 ARG 5 -15.590 -1.140 -10.890
43 1HH2 ARG 5 1HH2 ARG 5 -13.691 -0.808 -13.833
44 2HH2 ARG 5 2HH2 ARG 5 -14.835 -1.795 -12.968
45 H THR 6 H THR 6 -9.399 3.660 -11.224
46 HA THR 6 HA THR 6 -8.635 5.889 -9.620
47 HB THR 6 HB THR 6 -10.803 5.307 -8.548
48 HG1 THR 6 1HG THR 6 -9.626 6.097 -6.964
49 1HG2 THR 6 1HG2 THR 6 -9.475 2.657 -7.971
50 2HG2 THR 6 2HG2 THR 6 -10.855 2.916 -9.037
51 3HG2 THR 6 3HG2 THR 6 -11.014 3.196 -7.302
52 H SER 7 H SER 7 -7.655 3.654 -11.349
53 HA SER 7 HA SER 7 -6.520 1.596 -9.783
54 1HB SER 7 2HB SER 7 -5.629 2.453 -12.536
55 2HB SER 7 1HB SER 7 -5.557 0.839 -11.823
56 HG SER 7 HG SER 7 -7.465 0.544 -12.626
57 H PHE 8 H PHE 8 -5.545 4.798 -10.275
58 HA PHE 8 HA PHE 8 -2.745 4.527 -10.263
59 1HB PHE 8 2HB PHE 8 -3.945 6.606 -10.894
60 2HB PHE 8 1HB PHE 8 -4.400 6.829 -9.208
61 HD1 PHE 8 1HD PHE 8 -1.313 6.221 -11.220
62 HD2 PHE 8 2HD PHE 8 -3.134 8.299 -7.978
63 HE1 PHE 8 1HE PHE 8 0.786 7.451 -10.829
64 HE2 PHE 8 2HE PHE 8 -1.043 9.525 -7.584
65 HZ PHE 8 HZ PHE 8 0.920 9.104 -9.007
66 H VAL 9 H VAL 9 -5.131 4.647 -7.674
67 HA VAL 9 HA VAL 9 -3.352 5.009 -5.514
68 HB VAL 9 HB VAL 9 -6.001 3.546 -5.508
69 1HG1 VAL 9 1HG1 VAL 9 -4.723 3.095 -3.506
70 2HG1 VAL 9 2HG1 VAL 9 -6.072 4.166 -3.129
71 3HG1 VAL 9 3HG1 VAL 9 -4.439 4.818 -3.265
72 1HG2 VAL 9 1HG2 VAL 9 -5.391 6.464 -5.037
73 2HG2 VAL 9 2HG2 VAL 9 -6.961 5.695 -4.804
74 3HG2 VAL 9 3HG2 VAL 9 -6.254 5.783 -6.417
75 H LYS 10 H LYS 10 -4.757 2.083 -6.924
76 HA LYS 10 HA LYS 10 -3.518 0.192 -5.286
77 1HB LYS 10 2HB LYS 10 -5.364 -0.358 -6.786
78 2HB LYS 10 1HB LYS 10 -4.348 -0.037 -8.184
79 1HG LYS 10 2HG LYS 10 -2.914 -1.909 -7.582
80 2HG LYS 10 1HG LYS 10 -3.913 -2.221 -6.160
81 1HD LYS 10 2HD LYS 10 -5.828 -2.683 -7.580
82 2HD LYS 10 1HD LYS 10 -4.878 -2.300 -9.016
83 1HE LYS 10 2HE LYS 10 -3.393 -4.172 -8.556
84 2HE LYS 10 1HE LYS 10 -4.290 -4.536 -7.082
85 1HZ LYS 10 1HZ LYS 10 -6.239 -5.008 -8.407
86 2HZ LYS 10 2HZ LYS 10 -4.939 -5.976 -8.914
87 3HZ LYS 10 3HZ LYS 10 -5.402 -4.629 -9.836
88 H ARG 11 H ARG 11 -2.441 1.733 -8.260
89 HA ARG 11 HA ARG 11 -0.108 0.258 -8.680
90 1HB ARG 11 2HB ARG 11 -0.648 1.558 -10.496
91 2HB ARG 11 1HB ARG 11 -1.077 2.950 -9.513
92 1HG ARG 11 2HG ARG 11 1.147 3.612 -9.269
93 2HG ARG 11 1HG ARG 11 1.764 2.033 -9.756
94 1HD ARG 11 2HD ARG 11 0.189 3.785 -11.621
95 2HD ARG 11 1HD ARG 11 1.938 3.930 -11.449
96 HE ARG 11 HE ARG 11 1.322 1.239 -11.917
97 1HH1 ARG 11 1HH1 ARG 11 1.215 4.310 -13.594
98 2HH1 ARG 11 2HH1 ARG 11 1.503 3.618 -15.159
99 1HH2 ARG 11 1HH2 ARG 11 1.701 0.318 -13.961
100 2HH2 ARG 11 2HH2 ARG 11 1.779 1.333 -15.369
101 H ILE 12 H ILE 12 -0.609 3.225 -6.786
102 HA ILE 12 HA ILE 12 2.060 3.751 -6.176
103 HB ILE 12 HB ILE 12 -0.354 4.293 -4.440
104 1HG1 ILE 12 2HG1 ILE 12 1.031 6.074 -6.457
105 2HG1 ILE 12 1HG1 ILE 12 -0.500 5.247 -6.731
106 1HG2 ILE 12 1HG2 ILE 12 1.727 4.466 -3.194
107 2HG2 ILE 12 2HG2 ILE 12 1.017 6.060 -3.444
108 3HG2 ILE 12 3HG2 ILE 12 2.387 5.543 -4.424
109 1HD1 ILE 12 1HD1 ILE 12 0.027 7.364 -4.657
110 2HD1 ILE 12 2HD1 ILE 12 -1.505 6.527 -4.902
111 3HD1 ILE 12 3HD1 ILE 12 -0.857 7.573 -6.165
112 H ALA 13 H ALA 13 -0.339 1.942 -4.265
113 HA ALA 13 HA ALA 13 1.412 1.296 -2.150
114 1HB ALA 13 1HB ALA 13 -1.035 1.233 -1.953
115 2HB ALA 13 2HB ALA 13 -0.292 -0.284 -1.447
116 3HB ALA 13 3HB ALA 13 -1.075 -0.170 -3.022
117 H LYS 14 H LYS 14 0.450 -0.517 -5.042
118 HA LYS 14 HA LYS 14 1.761 -2.911 -4.339
119 1HB LYS 14 2HB LYS 14 -0.043 -2.390 -6.175
120 2HB LYS 14 1HB LYS 14 1.356 -2.109 -7.199
121 1HG LYS 14 2HG LYS 14 1.084 -4.648 -5.639
122 2HG LYS 14 1HG LYS 14 0.258 -4.438 -7.181
123 1HD LYS 14 2HD LYS 14 3.221 -4.020 -6.836
124 2HD LYS 14 1HD LYS 14 2.514 -5.578 -7.269
125 1HE LYS 14 2HE LYS 14 1.472 -4.511 -9.242
126 2HE LYS 14 1HE LYS 14 2.279 -3.002 -8.821
127 1HZ LYS 14 1HZ LYS 14 3.414 -4.389 -10.545
128 2HZ LYS 14 2HZ LYS 14 3.747 -5.529 -9.335
129 3HZ LYS 14 3HZ LYS 14 4.386 -3.957 -9.224
130 H GLU 15 H GLU 15 2.805 -0.072 -6.180
131 HA GLU 15 HA GLU 15 5.312 -1.203 -6.899
132 1HB GLU 15 2HB GLU 15 4.225 1.588 -6.966
133 2HB GLU 15 1HB GLU 15 5.921 1.265 -7.315
134 1HG GLU 15 2HG GLU 15 5.107 -0.414 -9.021
135 2HG GLU 15 1HG GLU 15 3.504 0.287 -8.796
136 H MET 16 H MET 16 4.196 0.637 -4.118
137 HA MET 16 HA MET 16 6.649 1.282 -2.967
138 1HB MET 16 2HB MET 16 4.045 0.453 -1.694
139 2HB MET 16 1HB MET 16 5.447 0.904 -0.739
140 1HG MET 16 2HG MET 16 5.447 3.110 -1.838
141 2HG MET 16 1HG MET 16 3.977 2.647 -2.700
142 1HE MET 16 1HE MET 16 2.710 5.244 -0.019
143 2HE MET 16 2HE MET 16 2.775 4.847 -1.735
144 3HE MET 16 3HE MET 16 4.252 5.271 -0.875
145 H ILE 17 H ILE 17 4.811 -1.719 -2.888
146 HA ILE 17 HA ILE 17 6.543 -3.180 -1.204
147 HB ILE 17 HB ILE 17 4.768 -4.271 -3.394
148 1HG1 ILE 17 2HG1 ILE 17 4.099 -3.818 -0.479
149 2HG1 ILE 17 1HG1 ILE 17 3.573 -2.772 -1.794
150 1HG2 ILE 17 1HG2 ILE 17 4.728 -6.303 -2.019
151 2HG2 ILE 17 2HG2 ILE 17 5.860 -5.553 -0.893
152 3HG2 ILE 17 3HG2 ILE 17 6.361 -5.898 -2.550
153 1HD1 ILE 17 1HD1 ILE 17 2.333 -4.626 -2.773
154 2HD1 ILE 17 2HD1 ILE 17 1.812 -4.301 -1.123
155 3HD1 ILE 17 3HD1 ILE 17 2.863 -5.676 -1.461
156 H GLU 18 H GLU 18 6.275 -3.119 -4.767
157 HA GLU 18 HA GLU 18 8.313 -5.039 -5.173
158 1HB GLU 18 2HB GLU 18 8.154 -4.477 -7.532
159 2HB GLU 18 1HB GLU 18 6.555 -4.637 -6.821
160 1HG GLU 18 2HG GLU 18 6.230 -2.293 -6.808
161 2HG GLU 18 1HG GLU 18 7.922 -1.991 -7.203
162 H THR 19 H THR 19 8.649 -1.865 -4.188
163 HA THR 19 HA THR 19 10.822 -0.911 -5.659
164 HB THR 19 HB THR 19 10.377 -0.482 -2.696
165 HG1 THR 19 1HG THR 19 8.568 0.396 -3.366
166 1HG2 THR 19 1HG2 THR 19 11.712 1.237 -4.796
167 2HG2 THR 19 2HG2 THR 19 12.536 0.327 -3.528
168 3HG2 THR 19 3HG2 THR 19 11.476 1.673 -3.102
169 H HIS 20 H HIS 20 10.738 -2.994 -2.799
170 HA HIS 20 HA HIS 20 13.309 -4.103 -3.549
171 1HB HIS 20 2HB HIS 20 13.967 -2.254 -2.077
172 2HB HIS 20 1HB HIS 20 12.873 -2.841 -0.830
173 HD1 HIS 20 1HD HIS 20 13.997 -4.169 0.927
174 HD2 HIS 20 2HD HIS 20 16.006 -4.397 -2.710
175 HE1 HIS 20 1HE HIS 20 16.017 -5.598 1.353
176 HE2 HIS 20 2HE HIS 20 17.312 -5.565 -0.805
177 HA PRO 21 HA PRO 21 10.857 -7.651 -2.295
178 1HB PRO 21 2HB PRO 21 13.474 -9.006 -2.621
179 2HB PRO 21 1HB PRO 21 11.914 -9.385 -3.357
180 1HG PRO 21 2HG PRO 21 13.876 -8.270 -4.789
181 2HG PRO 21 1HG PRO 21 12.179 -7.822 -5.043
182 1HD PRO 21 2HD PRO 21 14.333 -6.341 -3.588
183 2HD PRO 21 1HD PRO 21 13.050 -5.716 -4.644
184 H GLY 22 H GLY 22 10.465 -7.253 -0.251
185 1HA GLY 22 2HA GLY 22 11.838 -8.717 1.719
186 2HA GLY 22 1HA GLY 22 12.238 -7.005 1.863
187 H LYS 23 H LYS 23 10.984 -8.045 3.932
188 HA LYS 23 HA LYS 23 9.157 -7.958 5.290
189 1HB LYS 23 2HB LYS 23 8.323 -5.761 3.366
190 2HB LYS 23 1HB LYS 23 7.532 -6.102 4.891
191 1HG LYS 23 2HG LYS 23 8.924 -4.223 5.243
192 2HG LYS 23 1HG LYS 23 9.701 -5.588 6.041
193 1HD LYS 23 2HD LYS 23 11.275 -5.818 4.230
194 2HD LYS 23 1HD LYS 23 10.432 -4.585 3.293
195 1HE LYS 23 2HE LYS 23 11.539 -3.945 6.003
196 2HE LYS 23 1HE LYS 23 12.590 -3.948 4.588
197 1HZ LYS 23 1HZ LYS 23 11.720 -1.732 5.060
198 2HZ LYS 23 2HZ LYS 23 10.132 -2.306 4.901
199 3HZ LYS 23 3HZ LYS 23 11.162 -2.298 3.564
200 H PHE 24 H PHE 24 6.682 -6.908 3.332
201 HA PHE 24 HA PHE 24 5.213 -7.739 1.830
202 1HB PHE 24 2HB PHE 24 7.095 -8.453 0.505
203 2HB PHE 24 1HB PHE 24 7.283 -9.906 1.476
204 HD1 PHE 24 1HD PHE 24 5.024 -8.189 -0.904
205 HD2 PHE 24 2HD PHE 24 6.108 -11.866 0.948
206 HE1 PHE 24 1HE PHE 24 3.548 -9.402 -2.454
207 HE2 PHE 24 2HE PHE 24 4.636 -13.085 -0.599
208 HZ PHE 24 HZ PHE 24 3.353 -11.852 -2.303
209 H THR 25 H THR 25 6.260 -9.967 4.350
210 HA THR 25 HA THR 25 4.243 -11.899 3.638
211 HB THR 25 HB THR 25 5.117 -13.133 5.657
212 HG1 THR 25 1HG THR 25 5.931 -11.168 6.688
213 1HG2 THR 25 1HG2 THR 25 5.943 -13.583 3.393
214 2HG2 THR 25 2HG2 THR 25 7.238 -13.733 4.580
215 3HG2 THR 25 3HG2 THR 25 7.133 -12.294 3.568
216 H ASP 26 H ASP 26 2.570 -10.141 4.008
217 HA ASP 26 HA ASP 26 0.766 -9.359 5.192
218 1HB ASP 26 2HB ASP 26 0.128 -11.596 4.492
219 2HB ASP 26 1HB ASP 26 0.827 -12.282 5.949
220 H ASP 27 H ASP 27 2.326 -8.127 6.578
221 HA ASP 27 HA ASP 27 1.693 -8.697 9.369
222 1HB ASP 27 2HB ASP 27 3.888 -9.587 9.217
223 2HB ASP 27 1HB ASP 27 4.449 -8.241 8.236
224 H PHE 28 H PHE 28 1.573 -6.844 10.688
225 HA PHE 28 HA PHE 28 0.844 -4.468 9.231
226 1HB PHE 28 2HB PHE 28 0.907 -5.040 12.204
227 2HB PHE 28 1HB PHE 28 0.288 -3.556 11.486
228 HD1 PHE 28 1HD PHE 28 -0.388 -7.015 12.252
229 HD2 PHE 28 2HD PHE 28 -1.725 -3.635 10.040
230 HE1 PHE 28 1HE PHE 28 -2.597 -8.071 11.975
231 HE2 PHE 28 2HE PHE 28 -3.930 -4.682 9.760
232 HZ PHE 28 HZ PHE 28 -4.367 -6.904 10.729
233 H ASP 29 H ASP 29 3.498 -5.470 11.340
234 HA ASP 29 HA ASP 29 4.769 -2.935 11.437
235 1HB ASP 29 2HB ASP 29 5.374 -4.772 12.971
236 2HB ASP 29 1HB ASP 29 6.015 -5.693 11.615
237 H THR 30 H THR 30 4.667 -5.531 9.156
238 HA THR 30 HA THR 30 6.680 -4.768 7.382
239 HB THR 30 HB THR 30 4.136 -6.320 7.099
240 HG1 THR 30 1HG THR 30 6.233 -7.120 7.986
241 1HG2 THR 30 1HG2 THR 30 4.159 -5.330 4.969
242 2HG2 THR 30 2HG2 THR 30 4.947 -6.893 4.748
243 3HG2 THR 30 3HG2 THR 30 5.913 -5.420 4.849
244 H ASN 31 H ASN 31 3.209 -3.851 7.391
245 HA ASN 31 HA ASN 31 3.415 -2.321 5.024
246 1HB ASN 31 2HB ASN 31 1.197 -1.508 5.474
247 2HB ASN 31 1HB ASN 31 1.267 -3.215 5.874
248 1HD2 ASN 31 1HD2 ASN 31 -0.292 -3.400 7.326
249 2HD2 ASN 31 2HD2 ASN 31 -0.384 -2.516 8.815
250 H LYS 32 H LYS 32 3.784 -1.519 8.407
251 HA LYS 32 HA LYS 32 4.119 1.258 8.152
252 1HB LYS 32 2HB LYS 32 3.870 0.111 10.321
253 2HB LYS 32 1HB LYS 32 5.425 -0.673 10.085
254 1HG LYS 32 2HG LYS 32 6.260 1.821 9.879
255 2HG LYS 32 1HG LYS 32 4.807 2.131 10.836
256 1HD LYS 32 2HD LYS 32 6.551 1.808 12.401
257 2HD LYS 32 1HD LYS 32 5.630 0.302 12.399
258 1HE LYS 32 2HE LYS 32 7.300 -0.605 10.760
259 2HE LYS 32 1HE LYS 32 8.258 0.850 11.026
260 1HZ LYS 32 1HZ LYS 32 8.116 0.186 13.488
261 2HZ LYS 32 2HZ LYS 32 9.174 -0.678 12.482
262 3HZ LYS 32 3HZ LYS 32 7.678 -1.351 12.906
263 H LYS 33 H LYS 33 6.391 -1.433 8.027
264 HA LYS 33 HA LYS 33 8.711 0.184 7.820
265 1HB LYS 33 2HB LYS 33 8.419 -2.256 8.639
266 2HB LYS 33 1HB LYS 33 8.562 -2.683 6.941
267 1HG LYS 33 2HG LYS 33 10.772 -1.899 6.821
268 2HG LYS 33 1HG LYS 33 10.626 -1.024 8.349
269 1HD LYS 33 2HD LYS 33 10.634 -4.021 7.981
270 2HD LYS 33 1HD LYS 33 11.915 -3.041 8.702
271 1HE LYS 33 2HE LYS 33 10.352 -2.347 10.471
272 2HE LYS 33 1HE LYS 33 9.112 -3.378 9.766
273 1HZ LYS 33 1HZ LYS 33 11.639 -4.196 11.069
274 2HZ LYS 33 2HZ LYS 33 10.726 -5.265 10.121
275 3HZ LYS 33 3HZ LYS 33 10.046 -4.583 11.519
276 H LEU 34 H LEU 34 6.379 -0.770 5.505
277 HA LEU 34 HA LEU 34 8.143 -0.426 3.244
278 1HB LEU 34 2HB LEU 34 5.127 -0.557 3.406
279 2HB LEU 34 1HB LEU 34 6.040 -0.477 1.910
280 HG LEU 34 HG LEU 34 6.177 -2.723 3.925
281 1HD1 LEU 34 1HD1 LEU 34 5.061 -4.036 2.178
282 2HD1 LEU 34 2HD1 LEU 34 4.895 -2.578 1.201
283 3HD1 LEU 34 3HD1 LEU 34 4.059 -2.702 2.748
284 1HD2 LEU 34 1HD2 LEU 34 7.492 -3.876 2.198
285 2HD2 LEU 34 2HD2 LEU 34 8.299 -2.421 2.782
286 3HD2 LEU 34 3HD2 LEU 34 7.480 -2.407 1.221
287 H VAL 35 H VAL 35 5.544 1.443 4.773
288 HA VAL 35 HA VAL 35 5.850 3.663 2.988
289 HB VAL 35 HB VAL 35 4.410 3.571 5.647
290 1HG1 VAL 35 1HG1 VAL 35 4.097 5.441 3.302
291 2HG1 VAL 35 2HG1 VAL 35 4.813 5.842 4.864
292 3HG1 VAL 35 3HG1 VAL 35 3.099 5.434 4.756
293 1HG2 VAL 35 1HG2 VAL 35 3.568 1.836 4.179
294 2HG2 VAL 35 2HG2 VAL 35 3.377 3.004 2.871
295 3HG2 VAL 35 3HG2 VAL 35 2.385 3.136 4.325
296 H GLU 36 H GLU 36 7.226 2.746 6.038
297 HA GLU 36 HA GLU 36 7.998 5.379 6.844
298 1HB GLU 36 2HB GLU 36 7.611 3.150 8.225
299 2HB GLU 36 1HB GLU 36 9.342 2.970 7.957
300 1HG GLU 36 2HG GLU 36 8.851 4.049 10.091
301 2HG GLU 36 1HG GLU 36 9.757 5.110 9.010
302 H GLU 37 H GLU 37 9.117 3.823 4.264
303 HA GLU 37 HA GLU 37 11.677 5.130 4.410
304 1HB GLU 37 2HB GLU 37 13.020 3.120 3.918
305 2HB GLU 37 1HB GLU 37 12.287 3.076 5.513
306 1HG GLU 37 2HG GLU 37 10.605 1.535 4.727
307 2HG GLU 37 1HG GLU 37 11.237 1.642 3.084
308 H PHE 38 H PHE 38 9.662 2.859 2.509
309 HA PHE 38 HA PHE 38 10.875 3.848 0.066
310 1HB PHE 38 2HB PHE 38 8.518 1.977 0.413
311 2HB PHE 38 1HB PHE 38 9.375 2.297 -1.090
312 HD1 PHE 38 1HD PHE 38 12.083 1.993 -0.714
313 HD2 PHE 38 2HD PHE 38 8.972 -0.049 1.355
314 HE1 PHE 38 1HE PHE 38 13.629 0.145 -0.221
315 HE2 PHE 38 2HE PHE 38 10.516 -1.900 1.851
316 HZ PHE 38 HZ PHE 38 12.847 -1.805 1.064
317 H SER 39 H SER 39 7.419 3.372 0.429
318 HA SER 39 HA SER 39 5.620 4.731 0.232
319 1HB SER 39 2HB SER 39 6.656 5.537 2.381
320 2HB SER 39 1HB SER 39 7.432 6.822 1.462
321 HG SER 39 HG SER 39 5.338 7.285 2.548
322 H THR 40 H THR 40 5.440 7.469 -0.137
323 HA THR 40 HA THR 40 6.960 8.308 -2.450
324 HB THR 40 HB THR 40 3.936 8.099 -2.640
325 HG1 THR 40 1HG THR 40 5.904 6.307 -3.249
326 1HG2 THR 40 1HG2 THR 40 4.263 8.777 -4.966
327 2HG2 THR 40 2HG2 THR 40 6.000 8.910 -4.687
328 3HG2 THR 40 3HG2 THR 40 4.888 10.000 -3.859
329 H VAL 41 H VAL 41 4.142 8.823 -0.399
330 HA VAL 41 HA VAL 41 5.338 11.114 0.797
331 HB VAL 41 HB VAL 41 4.397 12.255 -1.131
332 1HG1 VAL 41 1HG1 VAL 41 2.008 12.296 -1.605
333 2HG1 VAL 41 2HG1 VAL 41 1.724 11.125 -0.316
334 3HG1 VAL 41 3HG1 VAL 41 2.654 10.661 -1.742
335 1HG2 VAL 41 1HG2 VAL 41 3.011 13.900 0.006
336 2HG2 VAL 41 2HG2 VAL 41 4.374 13.407 1.013
337 3HG2 VAL 41 3HG2 VAL 41 2.761 12.776 1.342
338 H SER 42 H SER 42 5.036 10.574 2.846
339 HA SER 42 HA SER 42 2.952 8.719 3.544
340 1HB SER 42 2HB SER 42 4.984 10.036 5.354
341 2HB SER 42 1HB SER 42 4.061 8.568 5.681
342 HG SER 42 HG SER 42 6.409 8.723 4.548
343 H THR 43 H THR 43 3.507 12.129 3.899
344 HA THR 43 HA THR 43 2.408 13.820 4.945
345 HB THR 43 HB THR 43 -0.066 13.807 4.726
346 HG1 THR 43 1HG THR 43 0.419 11.109 4.282
347 1HG2 THR 43 1HG2 THR 43 1.304 14.555 2.861
348 2HG2 THR 43 2HG2 THR 43 -0.126 13.705 2.271
349 3HG2 THR 43 3HG2 THR 43 1.442 12.896 2.275
350 H LYS 44 H LYS 44 -0.404 12.914 6.194
351 HA LYS 44 HA LYS 44 0.791 12.447 8.835
352 1HB LYS 44 2HB LYS 44 -1.882 13.602 8.043
353 2HB LYS 44 1HB LYS 44 -1.438 13.225 9.702
354 1HG LYS 44 2HG LYS 44 0.004 15.171 7.911
355 2HG LYS 44 1HG LYS 44 -1.139 15.596 9.187
356 1HD LYS 44 2HD LYS 44 0.317 14.658 10.865
357 2HD LYS 44 1HD LYS 44 1.417 14.059 9.623
358 1HE LYS 44 2HE LYS 44 0.783 16.969 10.095
359 2HE LYS 44 1HE LYS 44 2.203 16.138 10.724
360 1HZ LYS 44 1HZ LYS 44 1.548 16.376 7.832
361 2HZ LYS 44 2HZ LYS 44 2.967 15.731 8.507
362 3HZ LYS 44 3HZ LYS 44 2.632 17.386 8.660
363 H HIS 45 H HIS 45 -2.240 11.580 7.136
364 HA HIS 45 HA HIS 45 -2.257 9.126 8.761
365 1HB HIS 45 2HB HIS 45 -4.425 10.899 7.759
366 2HB HIS 45 1HB HIS 45 -4.778 9.185 7.958
367 HD1 HIS 45 1HD HIS 45 -4.725 12.301 9.792
368 HD2 HIS 45 2HD HIS 45 -4.179 8.277 10.708
369 HE1 HIS 45 1HE HIS 45 -5.035 12.118 12.287
370 HE2 HIS 45 2HE HIS 45 -4.671 9.678 12.824
371 H LEU 46 H LEU 46 -1.727 10.140 5.601
372 HA LEU 46 HA LEU 46 -3.001 8.065 4.167
373 1HB LEU 46 2HB LEU 46 -2.073 10.098 3.104
374 2HB LEU 46 1HB LEU 46 -0.457 9.521 3.454
375 HG LEU 46 HG LEU 46 -0.837 7.577 1.985
376 1HD1 LEU 46 1HD1 LEU 46 -3.254 7.393 2.216
377 2HD1 LEU 46 2HD1 LEU 46 -2.800 7.542 0.518
378 3HD1 LEU 46 3HD1 LEU 46 -3.463 8.930 1.380
379 1HD2 LEU 46 1HD2 LEU 46 -1.374 10.249 0.692
380 2HD2 LEU 46 2HD2 LEU 46 -0.794 8.804 -0.135
381 3HD2 LEU 46 3HD2 LEU 46 0.212 9.584 1.087
382 H ARG 47 H ARG 47 0.103 8.322 5.793
383 HA ARG 47 HA ARG 47 1.422 6.038 5.082
384 1HB ARG 47 2HB ARG 47 2.484 7.445 6.651
385 2HB ARG 47 1HB ARG 47 1.114 7.396 7.751
386 1HG ARG 47 2HG ARG 47 1.642 4.944 8.091
387 2HG ARG 47 1HG ARG 47 3.154 5.251 7.238
388 1HD ARG 47 2HD ARG 47 2.373 6.978 9.547
389 2HD ARG 47 1HD ARG 47 3.060 5.386 9.847
390 HE ARG 47 HE ARG 47 5.101 6.101 8.943
391 1HH1 ARG 47 1HH1 ARG 47 2.707 8.677 8.935
392 2HH1 ARG 47 2HH1 ARG 47 3.886 9.935 8.715
393 1HH2 ARG 47 1HH2 ARG 47 6.632 7.748 8.687
394 2HH2 ARG 47 2HH2 ARG 47 6.109 9.407 8.555
395 H ASN 48 H ASN 48 -1.122 6.281 7.556
396 HA ASN 48 HA ASN 48 -1.009 3.466 8.127
397 1HB ASN 48 2HB ASN 48 -2.919 5.616 9.057
398 2HB ASN 48 1HB ASN 48 -2.915 3.959 9.653
399 1HD2 ASN 48 1HD2 ASN 48 -1.295 3.283 11.029
400 2HD2 ASN 48 2HD2 ASN 48 -0.197 4.385 11.786
401 H LYS 49 H LYS 49 -2.957 5.540 6.116
402 HA LYS 49 HA LYS 49 -5.134 3.695 5.853
403 1HB LYS 49 2HB LYS 49 -4.414 6.326 4.708
404 2HB LYS 49 1HB LYS 49 -5.408 5.300 3.687
405 1HG LYS 49 2HG LYS 49 -6.763 6.821 5.013
406 2HG LYS 49 1HG LYS 49 -7.079 5.141 5.448
407 1HD LYS 49 2HD LYS 49 -5.686 5.363 7.422
408 2HD LYS 49 1HD LYS 49 -5.266 7.015 6.967
409 1HE LYS 49 2HE LYS 49 -6.981 7.043 8.678
410 2HE LYS 49 1HE LYS 49 -7.633 7.652 7.158
411 1HZ LYS 49 1HZ LYS 49 -8.559 5.389 6.779
412 2HZ LYS 49 2HZ LYS 49 -9.226 6.197 8.108
413 3HZ LYS 49 3HZ LYS 49 -8.082 4.968 8.353
414 H ILE 50 H ILE 50 -2.460 4.722 3.754
415 HA ILE 50 HA ILE 50 -3.104 2.908 1.690
416 HB ILE 50 HB ILE 50 -1.643 5.016 1.545
417 1HG1 ILE 50 2HG1 ILE 50 -0.693 2.474 0.229
418 2HG1 ILE 50 1HG1 ILE 50 -2.087 3.425 -0.279
419 1HG2 ILE 50 1HG2 ILE 50 0.759 4.698 1.764
420 2HG2 ILE 50 2HG2 ILE 50 0.504 3.051 2.342
421 3HG2 ILE 50 3HG2 ILE 50 -0.046 4.419 3.309
422 1HD1 ILE 50 1HD1 ILE 50 -0.624 5.297 -0.796
423 2HD1 ILE 50 2HD1 ILE 50 -0.150 3.850 -1.684
424 3HD1 ILE 50 3HD1 ILE 50 0.774 4.359 -0.270
425 H ALA 51 H ALA 51 -1.089 2.687 4.553
426 HA ALA 51 HA ALA 51 0.195 0.248 3.944
427 1HB ALA 51 1HB ALA 51 -0.508 1.370 6.652
428 2HB ALA 51 2HB ALA 51 0.945 1.755 5.730
429 3HB ALA 51 3HB ALA 51 0.684 0.113 6.319
430 H GLY 52 H GLY 52 -2.841 1.013 5.586
431 1HA GLY 52 2HA GLY 52 -3.595 -1.608 6.263
432 2HA GLY 52 1HA GLY 52 -4.704 -0.271 5.984
433 H TYR 53 H TYR 53 -4.117 0.290 3.342
434 HA TYR 53 HA TYR 53 -5.638 -1.614 1.940
435 1HB TYR 53 2HB TYR 53 -5.505 0.733 1.256
436 2HB TYR 53 1HB TYR 53 -3.793 0.547 0.887
437 HD1 TYR 53 1HD TYR 53 -3.233 0.278 -1.321
438 HD2 TYR 53 2HD TYR 53 -7.049 -1.077 -0.010
439 HE1 TYR 53 1HE TYR 53 -3.792 -0.365 -3.625
440 HE2 TYR 53 2HE TYR 53 -7.618 -1.723 -2.314
441 HH TYR 53 HH TYR 53 -6.966 -1.220 -4.588
442 H ILE 54 H ILE 54 -2.131 -1.004 2.018
443 HA ILE 54 HA ILE 54 -1.278 -2.924 0.202
444 HB ILE 54 HB ILE 54 0.059 -2.095 2.787
445 1HG1 ILE 54 2HG1 ILE 54 0.546 -1.171 -0.052
446 2HG1 ILE 54 1HG1 ILE 54 -0.368 -0.271 1.156
447 1HG2 ILE 54 1HG2 ILE 54 1.229 -3.532 0.410
448 2HG2 ILE 54 2HG2 ILE 54 0.941 -4.231 2.001
449 3HG2 ILE 54 3HG2 ILE 54 2.136 -2.947 1.803
450 1HD1 ILE 54 1HD1 ILE 54 2.538 -1.023 1.359
451 2HD1 ILE 54 2HD1 ILE 54 1.621 -0.086 2.539
452 3HD1 ILE 54 3HD1 ILE 54 1.908 0.566 0.926
453 H THR 55 H THR 55 -1.534 -3.314 3.737
454 HA THR 55 HA THR 55 -0.965 -6.024 3.870
455 HB THR 55 HB THR 55 -2.966 -4.740 5.711
456 HG1 THR 55 1HG THR 55 -1.317 -3.201 5.497
457 1HG2 THR 55 1HG2 THR 55 -2.384 -7.092 6.082
458 2HG2 THR 55 2HG2 THR 55 -1.790 -6.076 7.395
459 3HG2 THR 55 3HG2 THR 55 -0.676 -6.657 6.158
460 H ARG 56 H ARG 56 -4.059 -4.391 3.349
461 HA ARG 56 HA ARG 56 -5.756 -6.599 3.590
462 1HB ARG 56 2HB ARG 56 -6.465 -4.215 3.507
463 2HB ARG 56 1HB ARG 56 -6.111 -4.199 1.785
464 1HG ARG 56 2HG ARG 56 -7.838 -5.812 1.362
465 2HG ARG 56 1HG ARG 56 -8.124 -6.012 3.093
466 1HD ARG 56 2HD ARG 56 -8.771 -3.629 3.224
467 2HD ARG 56 1HD ARG 56 -8.580 -3.510 1.474
468 HE ARG 56 HE ARG 56 -10.321 -5.460 1.556
469 1HH1 ARG 56 1HH1 ARG 56 -10.241 -2.563 3.541
470 2HH1 ARG 56 2HH1 ARG 56 -11.957 -2.559 3.820
471 1HH2 ARG 56 1HH2 ARG 56 -12.571 -5.442 1.910
472 2HH2 ARG 56 2HH2 ARG 56 -13.287 -4.193 2.880
473 H ILE 57 H ILE 57 -3.970 -5.363 0.790
474 HA ILE 57 HA ILE 57 -5.043 -7.210 -1.086
475 HB ILE 57 HB ILE 57 -2.380 -5.775 -1.146
476 1HG1 ILE 57 2HG1 ILE 57 -5.020 -5.051 -2.441
477 2HG1 ILE 57 1HG1 ILE 57 -4.326 -4.254 -1.030
478 1HG2 ILE 57 1HG2 ILE 57 -2.356 -7.669 -2.643
479 2HG2 ILE 57 2HG2 ILE 57 -2.471 -6.179 -3.579
480 3HG2 ILE 57 3HG2 ILE 57 -3.903 -7.180 -3.337
481 1HD1 ILE 57 1HD1 ILE 57 -2.422 -3.537 -2.389
482 2HD1 ILE 57 2HD1 ILE 57 -3.954 -2.951 -3.035
483 3HD1 ILE 57 3HD1 ILE 57 -3.142 -4.318 -3.798
484 H ILE 58 H ILE 58 -2.192 -7.219 0.998
485 HA ILE 58 HA ILE 58 -1.042 -9.587 -0.023
486 HB ILE 58 HB ILE 58 -0.715 -8.411 2.743
487 1HG1 ILE 58 2HG1 ILE 58 -0.123 -6.794 0.999
488 2HG1 ILE 58 1HG1 ILE 58 1.323 -7.367 1.823
489 1HG2 ILE 58 1HG2 ILE 58 0.026 -10.709 2.654
490 2HG2 ILE 58 2HG2 ILE 58 1.424 -9.637 2.735
491 3HG2 ILE 58 3HG2 ILE 58 0.970 -10.380 1.201
492 1HD1 ILE 58 1HD1 ILE 58 1.768 -8.887 -0.043
493 2HD1 ILE 58 2HD1 ILE 58 1.698 -7.201 -0.558
494 3HD1 ILE 58 3HD1 ILE 58 0.335 -8.275 -0.870
495 H SER 59 H SER 59 -3.143 -9.000 2.793
496 HA SER 59 HA SER 59 -3.333 -11.627 3.711
497 1HB SER 59 2HB SER 59 -5.545 -9.561 3.758
498 2HB SER 59 1HB SER 59 -5.346 -10.928 4.855
499 HG SER 59 HG SER 59 -3.151 -9.779 5.222
500 H GLN 60 H GLN 60 -5.105 -9.960 1.158
501 HA GLN 60 HA GLN 60 -7.014 -11.993 0.665
502 1HB GLN 60 2HB GLN 60 -7.237 -9.651 -0.102
503 2HB GLN 60 1HB GLN 60 -5.923 -9.911 -1.240
504 1HG GLN 60 2HG GLN 60 -7.277 -11.633 -2.365
505 2HG GLN 60 1HG GLN 60 -8.604 -11.283 -1.256
506 1HE2 GLN 60 1HE2 GLN 60 -7.945 -8.419 -1.231
507 2HE2 GLN 60 2HE2 GLN 60 -8.512 -7.782 -2.739
508 H GLN 61 H GLN 61 -3.784 -11.379 -0.537
509 HA GLN 61 HA GLN 61 -3.815 -13.433 -2.533
510 1HB GLN 61 2HB GLN 61 -2.384 -11.485 -2.771
511 2HB GLN 61 1HB GLN 61 -1.581 -11.843 -1.254
512 1HG GLN 61 2HG GLN 61 -1.459 -13.850 -3.447
513 2HG GLN 61 1HG GLN 61 -0.464 -12.400 -3.556
514 1HE2 GLN 61 1HE2 GLN 61 -0.214 -12.287 -0.599
515 2HE2 GLN 61 2HE2 GLN 61 0.938 -13.507 -0.192
516 H LYS 62 H LYS 62 -3.236 -13.284 0.834
517 HA LYS 62 HA LYS 62 -1.502 -15.534 1.077
518 1HB LYS 62 2HB LYS 62 -1.586 -13.661 2.680
519 2HB LYS 62 1HB LYS 62 -3.213 -14.136 3.134
520 1HG LYS 62 2HG LYS 62 -2.435 -16.136 4.155
521 2HG LYS 62 1HG LYS 62 -0.813 -15.917 3.481
522 1HD LYS 62 2HD LYS 62 -0.500 -13.908 4.796
523 2HD LYS 62 1HD LYS 62 -2.150 -14.018 5.405
524 1HE LYS 62 2HE LYS 62 -1.626 -16.035 6.603
525 2HE LYS 62 1HE LYS 62 -0.011 -16.081 5.890
526 1HZ LYS 62 1HZ LYS 62 -0.370 -15.086 8.258
527 2HZ LYS 62 2HZ LYS 62 -0.834 -13.696 7.406
528 3HZ LYS 62 3HZ LYS 62 0.715 -14.352 7.183